SCHEMBL7142901

SCHEMBL7142901

Cc1cc(C)c(O)c(C(=O)Nc2sc(Cc3ccccc3)cc2C(N)=O)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.63
MAPT P10636 6/20 0.63
HPGD P15428 5/20 0.63
KDM4E B2RXH2 5/20 0.63
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
HSD17B10 Q99714 4/20 0.63
NPSR1 Q6W5P4 3/20 0.63
ALOX15 P16050 3/20 0.63
RAB9A P51151 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
NPC1 O15118 1/20 0.63
LMNA P02545 1/20 0.63
MAPK10 P53779 1/20 0.63
USP2 O75604 2/20 0.46
MAPK1 P28482 1/20 0.46
GFER P55789 1/20 0.46
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL7675269 0.87 ALDH1A1 (0.65) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL7003377 0.83 ALDH1A1 (0.80) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL24489106 0.81 ALDH1A1 (0.76) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL7670139 0.80 MAPT (0.62) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL7145607 0.79 MAPT (0.61) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL24489094 0.79 ALDH1A1 (0.67) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL24489117 0.79 ALDH1A1 (0.70) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL6995919 0.79 ALDH1A1 (0.67) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL5096639 0.79 ALDH1A1 (0.73) ALDH1A1MAPTHPGDKDM4EMEN1
SCHEMBL6999373 0.78 ALDH1A1 (0.65) ALDH1A1MAPTHPGDKDM4EMEN1

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
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
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