SCHEMBL992906

SCHEMBL992906

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

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
EPHX2 P34913 1/20 0.43
FABP5 Q01469 3/20 0.41
FABP7 O15540 2/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
TLR2 O60603 6/20 0.40
HTR2A P28223 1/20 0.38

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
SCHEMBL31135497 0.99 KMT2A (0.44) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL31135500 0.99 KMT2A (0.44) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL31135498 0.96 KMT2A (0.46) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL28402889 0.91 KMT2A (0.48) KMT2AEPHX2FABP5FABP7CA1
Hydrochloric Acid SCHEMBL2524995 0.90 KMT2A (0.47) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL887718 0.89 KMT2A (0.44) KMT2AEPHX2FABP5FABP7CA1
SCHEMBL30945377 0.86 KMT2A (0.45) KMT2AFABP5FABP7TLR2
SCHEMBL2182540 0.86 KMT2A (0.45) KMT2AFABP5FABP7TLR2
SCHEMBL30945369 0.86 KMT2A (0.45) KMT2AFABP5FABP7TLR2
SCHEMBL18614183 0.86 KMT2A (0.45) KMT2AFABP5FABP7TLR2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024221952-A1 NANO-DELIVERY SYSTEM OF NUCLEOTIDE DRUG, AND PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院苏州纳米技术与纳米仿生研究所 2024-10-31 WO claimed
WO-2024221952-A1 NANO-DELIVERY SYSTEM OF NUCLEOTIDE DRUG, AND PREPARATION METHOD THEREFOR AND USE THEREOF 中国科学院苏州纳米技术与纳米仿生研究所 2024-10-31 WO disclosed
US-20140357569-A1 CYCLOSPORIN CONJUGATES UCL BUSINESS PLC (GB) 2014-12-04 US disclosed
US-20120157385-A1 CYCLOSPORIN CONJUGATES UCL BUSINESS PLC (GB) 2012-06-21 US disclosed
EP-2453925-A2 CYCLOSPORIN CONJUGATES UCL Business PLC (GB) 2012-05-23 EP disclosed
WO-2011010084-A2 CYCLOSPORIN CONJUGATES UCL BUSINES PLC (GB) 2011-01-27 WO 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 (2 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-20120157385-A1 CYCLOSPORIN CONJUGATES CYP11B1, SHMT2, MRM1 KMT2A 3065/4885EPHX2 3072/4885FABP5 3618/4885
US-20140357569-A1 CYCLOSPORIN CONJUGATES CYP11B1, SHMT2, MRM1 KMT2A 3078/4885EPHX2 3198/4885FABP5 3694/4885

“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.