SCHEMBL7308544

SCHEMBL7308544

O=c1cc(O)c2ccsc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 6/20 0.51
PARP15 Q460N3 5/20 0.51
PARP10 Q53GL7 4/20 0.51
PARP2 Q9UGN5 4/20 0.51
ERCC1 P07992 1/20 0.47
ERCC5 P28715 1/20 0.47
FEN1 P39748 1/20 0.47
ERCC4 Q92889 1/20 0.47
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TNKS O95271 1/20 0.46
PARP1 P09874 1/20 0.46
MAPK1 P28482 1/20 0.46
KDM5A P29375 1/20 0.42
PARP14 Q460N5 1/20 0.41
AR P10275 1/20 0.39
DAO P14920 2/20 0.38
PDPK1 O15530 1/20 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
SCHEMBL30590336 0.77 TNKS2 (0.48) TNKS2PARP15PARP10PARP2ERCC1
SCHEMBL31139871 0.74 TNKS2 (0.43) TNKS2PARP15PARP10PARP2ERCC1
Trifluoroacetic Acid SCHEMBL29656976 0.70 TNKS2 (0.41) TNKS2PARP15PARP10PARP2ERCC1
SCHEMBL7302300 0.69 PDPK1 (0.62) ALDH1A1KDM4EMEN1KMT2APARP1
SCHEMBL31549277 0.68 TNKS2 (0.44) TNKS2PARP15PARP10PARP2ERCC1
SCHEMBL16776795 0.67 L3MBTL1 (0.43) TNKS2PARP15ALDH1A1KDM4ETNKS
SCHEMBL1549859 0.67 TNKS2 (0.60) TNKS2PARP15PARP10PARP2ERCC1
SCHEMBL2539403 0.67 KDM4E (0.58) TNKS2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL993597 0.65 KMT2A (0.66) TNKS2PARP15PARP10PARP2ERCC1
SCHEMBL3359790 0.65 DAO (0.53) TNKS2PARP15PARP10PARP2TNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505058-B1 Thienopyridine derivatives and pharmaceutical compositions containing them KYOWA HAKKO KOGYO KK (JP) 1997-05-21 EP disclosed
EP-0503844-B1 Thienopyridine derivatives and pharmaceutical compositions containing them KYOWA HAKKO KOGYO KK (JP) 1994-08-03 EP disclosed
US-5219864-A Prevention, treatment of osteoporosis KYOWA HAKKO KOGYO CO., LTD. (JP) 1993-06-15 US disclosed
US-5155115-A THIENOPYRIDINE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-10-13 US disclosed
EP-0505058-A1 Thienopyridine derivatives and pharmaceutical compositions containing them KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-09-23 EP disclosed
EP-0503844-A1 Thienopyridine derivatives and pharmaceutical compositions containing them KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-09-16 EP disclosed