SCHEMBL5314972

SCHEMBL5314972

Cc1nc2cc(NC(=O)COc3ccc(Cl)cc3)ccc2s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.68
LMNA P02545 3/20 0.68
HTT P42858 1/20 0.66
TP53 P04637 3/20 0.60
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
MAPK1 P28482 1/20 0.60
RXFP1 Q9HBX9 1/20 0.59
POLB P06746 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
THRB P10828 1/20 0.56
ALDH1A1 P00352 2/20 0.56
P2RY14 Q15391 1/20 0.55
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
KDM4E B2RXH2 1/20 0.53
HPGD P15428 1/20 0.53
HSD17B10 Q99714 1/20 0.53
HTR2B P41595 1/20 0.53

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
SCHEMBL5314825 0.89 MAPT (0.66) MAPTLMNAHTTTP53MEN1
SCHEMBL5319016 0.89 MAPT (0.83) MAPTLMNAHTTTP53MEN1
SCHEMBL4876016 0.82 MAPT (0.59) MAPTLMNAHTTMEN1KMT2A
SCHEMBL5312315 0.80 MAPT (0.55) MAPTLMNAHTTTP53MEN1
SCHEMBL4034628 0.80 RAB9A (0.61) MAPTLMNATP53KMT2ARXFP1
SCHEMBL5783405 0.79 TRPV1 (0.76) MAPTLMNAHTTMEN1KMT2A
SCHEMBL14419311 0.78 MAPT (0.52) MAPTLMNAHTTTP53MEN1
SCHEMBL14847474 0.78 RAB9A (0.65) MAPTLMNAHTTMEN1KMT2A
SCHEMBL15228759 0.77 RAB9A (0.62) MAPTLMNATP53KMT2ARXFP1
SCHEMBL4873851 0.77 MAPT (0.55) MAPTLMNAHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007067757-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS FOR MODULATING TRPV1 AMPHORA DISCOVERY CORPORATION (US) 2007-06-14 WO claimed
WO-2007067757-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS FOR MODULATING TRPV1 AMPHORA DISCOVERY CORPORATION (US) 2007-06-14 WO disclosed