SCHEMBL6973022

SCHEMBL6973022

Cc1oc(-c2ccccc2)nc1COc1ccc2c(c1)CCC(C=C1SC(=O)NC1=O)=C2

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.47
PPARA Q07869 6/20 0.47
KDR P35968 1/20 0.44
HPGD P15428 4/20 0.44
FFAR1 O14842 1/20 0.43
PTPN1 P18031 3/20 0.42
KCNH2 Q12809 1/20 0.42
POLB P06746 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
MAPT P10636 3/20 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
SCHEMBL8337047 1.00 PPARG (0.47) PPARGPPARAKDRHPGDFFAR1
SCHEMBL8336444 0.92 PPARG (0.46) PPARGPPARAKDRFFAR1MAPT
SCHEMBL8341031 0.86 PPARG (0.54) PPARGPPARAKDRFFAR1MAPT
SCHEMBL10365494 0.84 HPGD (0.61) PPARGPPARAHPGDFFAR1PTPN1
SCHEMBL10365493 0.84 HPGD (0.61) PPARGPPARAHPGDFFAR1PTPN1
SCHEMBL8799445 0.82 PPARG (0.45) PPARGPPARAKDRFFAR1MAPT
SCHEMBL8799441 0.82 PPARG (0.45) PPARGPPARAKDRFFAR1MAPT
SCHEMBL8128997 0.81 PPARG (0.47) PPARGPPARAKDRHPGDFFAR1
SCHEMBL8128996 0.81 PPARG (0.47) PPARGPPARAKDRHPGDFFAR1
SCHEMBL6972649 0.79 KDR (0.48) PPARGPPARAKDRHPGDFFAR1

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-0783496-B9 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-09-03 EP disclosed
EP-0783496-B1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-03-26 EP disclosed
US-5965589-A AN ACTIVE MATERIAL HAVING HYPOGLYCEMIC ACTIVITY AND BLOOD LIPID LOWERING ACTIVITY, FOR USE AS AN ANTIDIABETIC AGENT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-12 US disclosed