SCHEMBL7828861

SCHEMBL7828861

Cc1c(C)c2c(c(C)c1OCC(N)=O)CCC(C)(COc1ccc(C=C3SC(=O)NC3=O)cc1)O2

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
HPGD P15428 5/20 0.48
PARP1 P09874 1/20 0.48
GPR35 Q9HC97 1/20 0.46
PIM1 P11309 2/20 0.44
PIM2 Q9P1W9 2/20 0.44
HDAC4 P56524 2/20 0.41
PPARG P37231 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
CISD1 Q9NZ45 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
PTGS2 P35354 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
SCHEMBL7828419 0.92 GPR35 (0.57) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL7828865 0.92 MEN1 (0.47) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL7837647 0.89 MEN1 (0.46) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL7828846 0.88 HPGD (0.49) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL7836423 0.88 HPGD (0.56) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL16282035 0.88 HPGD (0.56) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL7829489 0.87 HPGD (0.48) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL7828466 0.87 GPR35 (0.47) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL7836536 0.87 ALOX5 (0.49) MEN1MAPTKMT2ATDP1HPGD
SCHEMBL13256854 0.87 MEN1 (0.48) MEN1MAPTKMT2ATDP1HPGD

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