SCHEMBL7002682

SCHEMBL7002682

NC(=O)c1cc(Cc2ccccc2)sc1NC(=O)Cc1c[nH]cn1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.59
NPSR1 Q6W5P4 3/20 0.59
KDM4E B2RXH2 3/20 0.59
ALDH1A1 P00352 3/20 0.59
HPGD P15428 3/20 0.59
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
ALOX15 P16050 1/20 0.55
MAPK10 P53779 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MAPK8 P45983 11/20 0.46

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
SCHEMBL24489005 0.78 ALDH1A1 (0.62) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL24489102 0.78 ALDH1A1 (0.59) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL24489088 0.78 ALDH1A1 (0.67) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL6995919 0.78 ALDH1A1 (0.67) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL5096639 0.77 ALDH1A1 (0.73) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL24489002 0.77 ALDH1A1 (0.65) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL24489136 0.76 MAPT (0.62) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL7003377 0.74 ALDH1A1 (0.80) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL24489106 0.74 ALDH1A1 (0.76) MAPTNPSR1KDM4EALDH1A1HPGD
SCHEMBL7142458 0.74 ALDH1A1 (0.61) MAPTNPSR1KDM4EALDH1A1HPGD

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
EP-1294707-A2 THIOPHENE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2003-03-26 EP claimed
US-6414013-B1 KINASE INHIBITORS; ANTICANCER AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-07-02 US claimed
WO-2001098290-A2 THIOPHENE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA S.P.A. (IT) 2001-12-27 WO claimed