SCHEMBL10372016

SCHEMBL10372016

Cc1oc(-c2ccccc2)nc1COc1ccc(N)cc1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.65
KDR P35968 1/20 0.61
PPARG P37231 10/20 0.59
PPARA Q07869 10/20 0.59
MAPT P10636 3/20 0.54
TP53 P04637 1/20 0.52
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL19392906 0.89 FFAR1 (0.68) FFAR1KDRPPARGPPARAMAPT
SCHEMBL4030957 0.88 FFAR1 (0.70) FFAR1KDRPPARGPPARAMAPT
SCHEMBL4032011 0.88 FFAR1 (0.70) FFAR1KDRPPARGPPARAMAPT
SCHEMBL7736876 0.87 PPARG (0.74) PPARGPPARA
SCHEMBL6157895 0.86 FFAR1 (0.68) FFAR1KDRPPARGPPARAMAPT
SCHEMBL9721982 0.86 KDR (0.71) FFAR1KDRPPARGPPARAMAPT
SCHEMBL14302921 0.85 PPARG (0.61) FFAR1KDRPPARGPPARAMAPT
SCHEMBL14281856 0.85 PPARG (0.61) FFAR1KDRPPARGPPARAMAPT
SCHEMBL6248263 0.85 KDR (0.63) FFAR1KDRPPARGPPARAMAPT
SCHEMBL4850325 0.84 FFAR1 (0.69) FFAR1KDRPPARGPPARAMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0177353-B1 THIAZOLIDINEDIONE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1990-04-11 EP disclosed
US-4725610-A TREATMENT OF HYPERLIPEMIA AND DIABETES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-02-16 US disclosed