SCHEMBL7828849

SCHEMBL7828849

Cc1c(C)c2c(c(C)c1OC(C)(C)C(=O)O)CCC(C)(COc1ccc(C=C3SC(=O)NC3=O)cc1)O2

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 10/20 0.46
PARP1 P09874 1/20 0.46
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
GPR35 Q9HC97 1/20 0.45
PIM1 P11309 2/20 0.42
PIM2 Q9P1W9 2/20 0.42
MAOA P21397 2/20 0.40
MAOB P27338 2/20 0.40
PTPN1 P18031 1/20 0.40
POLB P06746 1/20 0.40
CISD1 Q9NZ45 1/20 0.39
PPARG P37231 1/20 0.39
PTGS2 P35354 1/20 0.39

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
SCHEMBL7828852 0.92 MEN1 (0.44) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL7837317 0.91 PIM1 (0.45) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL7828419 0.88 GPR35 (0.57) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL7828846 0.87 HPGD (0.49) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL15150892 0.86 HPGD (0.46) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL16282035 0.86 HPGD (0.56) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL7836423 0.86 HPGD (0.56) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL7837647 0.86 MEN1 (0.46) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL7828466 0.85 GPR35 (0.47) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL7828861 0.85 MEN1 (0.48) HPGDPARP1MEN1MAPTKMT2A

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