SCHEMBL8138656

SCHEMBL8138656

COC(=O)c1cc2ccc(OCc3nc(-c4ccccc4)oc3C)cc2o1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.63
PPARA Q07869 11/20 0.63
FFAR1 O14842 1/20 0.59
KDR P35968 1/20 0.59
MAPT P10636 4/20 0.53
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL8154817 0.93 FFAR1 (0.60) PPARGPPARAFFAR1KDRMAPT
SCHEMBL8692244 0.84 KDR (0.57) PPARGPPARAFFAR1KDRMAPT
SCHEMBL8694598 0.84 KDR (0.59) PPARGPPARAFFAR1KDRMAPT
SCHEMBL4848768 0.83 FFAR1 (0.54) PPARGPPARAFFAR1KDRMAPT
SCHEMBL3278854 0.82 MAPT (0.68) PPARGPPARAFFAR1KDRMAPT
SCHEMBL1067965 0.81 MAOA (0.64) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL8128837 0.81 KDR (0.66) PPARGPPARAFFAR1KDRMAPT
SCHEMBL8130715 0.81 FFAR1 (0.56) PPARGPPARAFFAR1KDRMAPT
SCHEMBL8130719 0.81 FFAR1 (0.56) PPARGPPARAFFAR1KDRMAPT
SCHEMBL8122331 0.81 KDR (0.56) PPARGPPARAFFAR1KDRMAPT

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-0733631-B1 Benzofuran derivates useful as hypoglycemic and hypolidemic agents TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2000-07-12 EP disclosed
US-5723479-A ANTILIPEMIC AGENTS AND ANTIGLYCEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-03 US disclosed
EP-0733631-A1 Benzofuran derivates useful as hypoglycemic and hypolidemic agents Takeda Chemical Industries, Ltd. (JP) 1996-09-25 EP disclosed