SCHEMBL2898462

SCHEMBL2898462

CC1(C)OC[C@H]([C@H]2OC(C)(C)O[C@H]2C(=O)O)O1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.43
CA1 P00915 7/20 0.43
CA9 Q16790 3/20 0.43
CA12 O43570 2/20 0.35
CA4 P22748 2/20 0.35
CA5A P35218 2/20 0.35
CA7 P43166 2/20 0.35
CA14 Q9ULX7 2/20 0.35
CA5B Q9Y2D0 2/20 0.35
CA6 P23280 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
MAPK1 P28482 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ELANE P08246 4/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
ACHE P22303 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
HCRTR1 O43613 1/20 0.31

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
SCHEMBL16153579 1.00 CA2 (0.43) CA2CA1CA9CA12CA4
SCHEMBL8098196 0.82 CA1 (0.33) CA2CA1CA9CA12CA4
SCHEMBL16153577 0.82 CA2 (0.43) CA2CA1CA9CA12CA4
SCHEMBL21302829 0.81 MAPK1 (0.33) CA2CA1CA9MAPK1NPSR1
SCHEMBL7155660 0.79 CA2 (0.49) CA2CA1CA9CA12CA4
SCHEMBL2368037 0.79 CA2 (0.49) CA2CA1CA9CA12CA4
SCHEMBL5048000 0.79 SUCNR1 (0.39) CA2MAPK1NPSR1GAA
SCHEMBL14007051 0.79 SUCNR1 (0.39) CA2MAPK1NPSR1GAA
SCHEMBL6854868 0.79 CA2 (0.49) CA2CA1CA9CA12CA4
SCHEMBL12708713 0.79 CA2 (0.49) CA2CA1CA9CA12CA4

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 18 patents. 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-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
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-9957246-B2 Prodrugs of tetrahydrocannabinol, compositions comprising prodrugs of tetrahydrocannabinol and methods of using the same ZYNERBA PHARMACEUTICALS, INC. (US) 2018-05-01 US disclosed
US-9695143-B2 Prodrugs of tetrahydrocannabinol, compositions comprising prodrugs of tetrahydrocannabinol and methods of using the same ZYNERBA PHARMACEUTICALS, INC. (US) 2017-07-04 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-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 (11 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 CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20200247774-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20190233387-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20200024248-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20150218121-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20090143462-A1 Products of Tetrahydrocannabinol, Compositions Comprising Prodrugs of Tetrahydrocannabinol and Methods of Using the Same CNR2, CNR1, FAAH CA2 3059/4885CA1 1785/4885CA9 670/4885
US-20220194916-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20190031637-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20170088533-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20210047284-A1 PRODRUGS OF TETRAHYDROCANNABINOL, COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 2700/4885CA1 1490/4885CA9 488/4885
US-20240217942-A1 PRODRUGS OF TETRAHYDROCANNABINOL COMPOSITIONS COMPRISING PRODRUGS OF TETRAHYDROCANNABINOL AND METHODS OF USING THE SAME CNR2, CNR1, FAAH CA2 3012/4885CA1 1679/4885CA9 720/4885

“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.