SCHEMBL5377170

SCHEMBL5377170

Cc1oc(-c2ccccc2)nc1COc1ccc(COc2nn(Cc3ccc(OCc4nc(-c5ccccc5)oc4C)cc3)cc2C=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.54
PPARG P37231 15/20 0.52
PPARA Q07869 14/20 0.52
KDR P35968 1/20 0.46
PPARD Q03181 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
MAPT P10636 1/20 0.43

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
SCHEMBL4851654 0.99 FFAR1 (0.53) FFAR1PPARGPPARAKDRPPARD
SCHEMBL5380734 0.93 FFAR1 (0.49) FFAR1PPARGPPARAKDRPPARD
SCHEMBL4848645 0.91 KDR (0.58) FFAR1PPARGPPARAKDRPTPN2
SCHEMBL6591750 0.90 FFAR1 (0.55) FFAR1PPARGPPARAKDRPPARD
SCHEMBL6591759 0.90 FFAR1 (0.55) FFAR1PPARGPPARAKDRPPARD
SCHEMBL4851874 0.88 FFAR1 (0.41) FFAR1PPARGPPARAKDRPTPN2
SCHEMBL4845677 0.88 PPARG (0.56) FFAR1PPARGPPARAKDRPTPN2
SCHEMBL5374488 0.87 FFAR1 (0.39) FFAR1PPARGPPARAMAPT
SCHEMBL5380793 0.87 FFAR1 (0.52) FFAR1PPARGPPARAKDRPPARD
SCHEMBL5380788 0.87 FFAR1 (0.52) FFAR1PPARGPPARAKDRPPARD

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
US-7179823-B1 5-membered n-heterocyclic compounds with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-20 US disclosed
EP-1457490-A1 5-membered N-heterocyclic compounds with hypoglycemic and hypolipidemic activity Takeda Chemical Industries, Ltd. (JP) 2004-09-15 EP disclosed
EP-1228067-B1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-07-14 EP disclosed
EP-1228067-A1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGYLCEMIC AND HYPOLIPIDEMIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 2002-08-07 EP disclosed
EP-0883611-B1 AZOLYL PIPERAZINYL PHENYL OXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 2002-07-31 EP disclosed
WO-2001038325-A1 5-MEMBERED N-HETEROCYCLIC COMPOUNDS WITH HYPOGLYCEMIC AND HYPOLIPIDEMIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-31 WO disclosed
US-5736545-A ADMINISTERING TO TREAT BACTERIAL INFECTIONS PHARMACIA & UPJOHN COMPANY (US) 1998-04-07 US disclosed