SCHEMBL10147708

SCHEMBL10147708

CCc1nc2ccc3cc(C)ccc3c2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
POLB P06746 2/20 0.44
ADORA1 P30542 4/20 0.41
DDAH1 O94760 1/20 0.40
CYP1A2 P05177 4/20 0.40
TNKS2 Q9H2K2 1/20 0.40
GAA P10253 2/20 0.38
HTT P42858 1/20 0.38
LMNA P02545 2/20 0.38
NCK1 P16333 1/20 0.38
BACE1 P56817 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ADORA3 P0DMS8 3/20 0.37

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
SCHEMBL2756731 0.80 CYP1A2 (0.44) KMT2APOLBCYP1A2GAALMNA
SCHEMBL12111149 0.79 TNKS2 (0.54) ADORA1DDAH1TNKS2GAAHTT
SCHEMBL19883176 0.76 KDM4E (0.38) ADORA1DDAH1TNKS2GAAHTT
SCHEMBL10141001 0.75 CYP1A2 (0.45) KMT2APOLBADORA1CYP1A2GAA
SCHEMBL10142439 0.75 KMT2A (0.74) KMT2APOLBDDAH1CYP1A2GAA
SCHEMBL17298075 0.73 TNKS2 (0.64) KMT2APOLBTNKS2GAALMNA
SCHEMBL17298077 0.73 TNKS2 (0.64) KMT2APOLBTNKS2LMNAKDM4E
SCHEMBL21897716 0.73 AAK1 (0.33) ADORA1DDAH1TNKS2GAAHTT
SCHEMBL12294883 0.73 CYP1A2 (0.43) POLBCYP1A2GAAHTTLMNA
SCHEMBL15747148 0.72 TYMS (0.42) KMT2APOLBCYP1A2GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676802-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2017-06-13 US disclosed
US-8933110-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2015-01-13 US disclosed
US-20120076755-A1 Hepatitis C Virus Inhibitors ENANTA PHARMACEUTICALS, INC. 2012-03-29 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 (1 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-20120076755-A1 Hepatitis C Virus Inhibitors NSUN2, HCCS, HAVCR2 KMT2A 1725/4885POLB 98/4885ADORA1 281/4885

“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.