SCHEMBL7142458

SCHEMBL7142458

NC(=O)c1cc(Cc2ccccc2)sc1NC(=O)COCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
MAPT P10636 4/20 0.61
KDM4E B2RXH2 4/20 0.61
HPGD P15428 3/20 0.61
NPSR1 Q6W5P4 3/20 0.61
NPC1 O15118 3/20 0.61
RAB9A P51151 3/20 0.61
HSD17B10 Q99714 3/20 0.61
MAPK10 P53779 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
MEN1 O00255 2/20 0.61
LMNA P02545 2/20 0.61
KMT2A Q03164 2/20 0.61
ALOX15 P16050 1/20 0.61
CSNK1D P48730 2/20 0.46
TP53 P04637 1/20 0.46
MAPK8 P45983 1/20 0.46
PTPRC P08575 1/20 0.44
PTPN1 P18031 1/20 0.44
IKBKB O14920 1/20 0.41

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
SCHEMBL24489136 0.86 MAPT (0.62) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL7675266 0.84 MAPT (0.58) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL24489088 0.83 ALDH1A1 (0.67) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL5096639 0.82 ALDH1A1 (0.73) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL7144732 0.82 MAPT (0.61) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL24489002 0.82 ALDH1A1 (0.65) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL24489106 0.79 ALDH1A1 (0.76) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL7003377 0.79 ALDH1A1 (0.80) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL24489005 0.79 ALDH1A1 (0.62) ALDH1A1MAPTKDM4EHPGDNPSR1
SCHEMBL6995919 0.78 ALDH1A1 (0.67) ALDH1A1MAPTKDM4EHPGDNPSR1

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