SCHEMBL7828846

SCHEMBL7828846

CC(=O)Oc1c(C)c(C)c2c(c1C)CCC(C)(COc1ccc(C=C3SC(=O)NC3=O)cc1)O2

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.49
PARP1 P09874 1/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
GPR35 Q9HC97 1/20 0.45
PIM1 P11309 3/20 0.45
PIM2 Q9P1W9 3/20 0.45
PDE4A P27815 1/20 0.45
PDE3A Q14432 1/20 0.45
CISD1 Q9NZ45 1/20 0.41
CTSD P07339 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
PTGS2 P35354 1/20 0.41
PPARG P37231 1/20 0.40
AKR1B1 P15121 1/20 0.40

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
SCHEMBL7829767 0.92 MEN1 (0.46) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL15150892 0.89 HPGD (0.46) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL13256908 0.89 HPGD (0.46) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL13256852 0.89 PTPN1 (0.49) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL16282035 0.89 HPGD (0.56) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL7836423 0.89 HPGD (0.56) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL7828419 0.89 GPR35 (0.57) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL13256909 0.89 HPGD (0.45) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL13256854 0.88 MEN1 (0.48) HPGDPARP1MEN1KMT2AMAPT
SCHEMBL7828861 0.88 MEN1 (0.48) HPGDPARP1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0454501-B1 Benzylidenethiazolidine derivatives, their preparation and their use for the inhibition of lipid peroxides SANKYO CO (JP) 2001-09-05 EP claimed
EP-0839812-A1 Preparation of benzylthiazolidine derivatives Sankyo Company Limited (JP) 1998-05-06 EP claimed
EP-0454501-A2 Benzylidenethiazolidine derivatives, their preparation and their use for the inhibition of lipid peroxides Sankyo Company Limited (JP) 1991-10-30 EP claimed
EP-0454501-B1 Benzylidenethiazolidine derivatives, their preparation and their use for the inhibition of lipid peroxides SANKYO CO (JP) 2001-09-05 EP disclosed
EP-0839812-A1 Preparation of benzylthiazolidine derivatives Sankyo Company Limited (JP) 1998-05-06 EP disclosed
US-5387596-A Treating arteriosclerosis SANKYO COMPANY, LIMITED (JP) 1995-02-07 US disclosed
EP-0454501-A2 Benzylidenethiazolidine derivatives, their preparation and their use for the inhibition of lipid peroxides Sankyo Company Limited (JP) 1991-10-30 EP disclosed