SCHEMBL8340671

SCHEMBL8340671

Cc1oc(-c2ccccc2)nc1COc1ccc2cc(/C=C/C=O)ccc2c1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.57
FFAR1 O14842 1/20 0.55
PPARG P37231 9/20 0.51
PPARA Q07869 9/20 0.51
CCNB2 O95067 2/20 0.48
CDK1 P06493 2/20 0.48
CDK4 P11802 2/20 0.48
CCNB1 P14635 2/20 0.48
CCND1 P24385 2/20 0.48
CCNB3 Q8WWL7 2/20 0.48
PTPN2 P17706 1/20 0.48
PTPN1 P18031 1/20 0.48
MAPT P10636 4/20 0.47
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL8340675 1.00 KDR (0.57) KDRFFAR1PPARGPPARACCNB2
SCHEMBL6955816 0.92 FFAR1 (0.61) KDRFFAR1PPARGPPARAMAPT
SCHEMBL6960376 0.91 KDR (0.63) KDRFFAR1PPARGPPARACCNB2
SCHEMBL6960372 0.91 KDR (0.63) KDRFFAR1PPARGPPARACCNB2
SCHEMBL7563293 0.90 KDR (0.60) KDRFFAR1PPARGPPARAPTPN2
SCHEMBL6957771 0.86 FFAR1 (0.49) KDRFFAR1PPARGPPARAMAPT
SCHEMBL6957767 0.86 FFAR1 (0.49) KDRFFAR1PPARGPPARAMAPT
SCHEMBL8139628 0.85 KDR (0.53) KDRFFAR1PPARGPPARAPTPN2
SCHEMBL8139624 0.85 KDR (0.53) KDRFFAR1PPARGPPARAPTPN2
SCHEMBL6584026 0.84 KDR (0.47) KDRFFAR1PPARGPPARAPTPN2

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
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
EP-0783496-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-07-16 EP disclosed
WO-1996005186-A1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-02-22 WO disclosed