SCHEMBL2905231

SCHEMBL2905231

O=C(O)N(CCCCO)C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
FABP5 Q01469 3/20 0.44
FABP7 O15540 2/20 0.44
EPHX2 P34913 1/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CASP3 P42574 2/20 0.36
MDM4 O15151 1/20 0.35
TP53 P04637 1/20 0.35
KDM4E B2RXH2 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1323242 0.83 KMT2A (0.47) KMT2AFABP5FABP7EPHX2
SCHEMBL5969982 0.82 FABP5 (0.49) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL14559049 0.82 KMT2A (0.45) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL28730478 0.82 KMT2A (0.62) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL119279 0.81 FABP5 (0.48) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL16612468 0.79 KMT2A (0.43) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL14656652 0.79 KMT2A (0.47) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL14300816 0.78 KMT2A (0.49) KMT2AFABP5FABP7EPHX2CASP3
SCHEMBL26123657 0.78 KMT2A (0.42) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL20371103 0.78 KMT2A (0.48) KMT2AFABP5FABP7EPHX2CA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217942-A1 PRODRUGS OF TETRAHYDROCANNABINOL COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS, INC. (US) 2024-07-04 US disclosed
US-20240083866-A1 PRODRUGS OF TETRAHYDROCANNABINOL COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS, INC. (US) 2024-03-14 US disclosed
US-20220194916-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS, INC. (US) 2022-06-23 US disclosed
US-20210047284-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS, INC. (US) 2021-02-18 US disclosed
US-20200247774-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS, INC. (US) 2020-08-06 US disclosed
US-20200024248-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS, INC. (US) 2020-01-23 US disclosed
US-20190233387-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS, INC. (US) 2019-08-01 US disclosed
EP-2963031-B1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS INC (US) 2019-02-06 EP disclosed
US-20190031637-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS (US) 2019-01-31 US disclosed
US-20180208572-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS INC (US) 2018-07-26 US disclosed
US-20170088533-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ALLTRANZ INC. 2017-03-30 US disclosed
EP-2963031-A2 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME Zynerba Pharmaceuticals, Inc. (US) 2016-01-06 EP disclosed
US-20150218121-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS, INC. (US) 2015-08-06 US disclosed
EP-2215071-B1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ZYNERBA PHARMACEUTICALS INC (US) 2015-07-01 EP disclosed
US-8980942-B2 Prodrugs of tetrahydrocannabinol, compositions comprising prodrugs of tetrahydrocannabinol and methods of using the same ZYNERBA PHARMACEUTICALS, INC. (US) 2015-03-17 US disclosed
US-20120289484-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ALLTRANZ INC. 2012-11-15 US disclosed
US-8227627-B2 Prodrugs of tetrahydrocannabinol, compositions comprising prodrugs of tetrahydrocannabinol and methods of using the same ALLTRANZ INC. (US) 2012-07-24 US disclosed
EP-2215071-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME AllTranz Inc. (US) 2010-08-11 EP disclosed
WO-2009073633-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME ALLTRANZ INC. (US) 2009-06-11 WO disclosed
US-20090143462-A1 Products of Tetrahydrocannabinol, Compositions Comprising Prodrugs of Tetrahydrocannabinol and Methods of Using the Same ALLTRANZ (US) 2009-06-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180208572-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20120289484-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20200247774-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20190233387-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20200024248-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20150218121-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20240083866-A1 PRODRUGS OF TETRAHYDROCANNABINOL COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1832/4885FABP5 2269/4885FABP7 844/4885
US-20090143462-A1 Products of Tetrahydrocannabinol, Compositions Comprising Prodrugs of Tetrahydrocannabinol and Methods of Using the Same CNR2, CNR1, FAAH KMT2A 1787/4885FABP5 2058/4885FABP7 737/4885
US-20220194916-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20190031637-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20170088533-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20210047284-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1714/4885FABP5 2054/4885FABP7 808/4885
US-20240217942-A1 PRODRUGS OF TETRAHYDROCANNABINOL COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH KMT2A 1832/4885FABP5 2269/4885FABP7 844/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.