SCHEMBL7675433

SCHEMBL7675433

Cc1oc(-c2ccccc2)nc1COc1ccc(CON=C2C=CC=C(C(C)C(=O)O)C2)cc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.56
PPARA Q07869 17/20 0.56
FFAR1 O14842 1/20 0.55
PPARD Q03181 1/20 0.46

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
SCHEMBL7623985 0.78 PPARG (0.55) PPARGPPARAFFAR1
SCHEMBL4057652 0.77 PPARG (0.68) PPARGPPARAFFAR1
SCHEMBL4057645 0.77 PPARG (0.68) PPARGPPARAFFAR1
SCHEMBL6157774 0.77 PPARG (0.68) PPARGPPARAFFAR1
SCHEMBL7623979 0.76 FFAR1 (0.62) PPARGPPARAFFAR1
SCHEMBL7675424 0.76 FFAR1 (0.65) PPARGPPARAFFAR1PPARD
SCHEMBL6157590 0.74 PPARG (0.66) PPARGPPARAFFAR1
SCHEMBL5202560 0.74 PPARG (0.61) PPARGPPARAFFAR1PPARD
SCHEMBL6156644 0.74 PPARG (0.66) PPARGPPARAFFAR1
SCHEMBL6156648 0.74 PPARG (0.66) PPARGPPARAFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6495581-B1 DRUG FOR TREATING DIABETES MELLITUS, HYPERLIPEMIA, IMPAIRED GLUCOSE TOLERANCE, ARTERIAL SCLEROSIS AND IMPROVING INSULIN RESISTANCE, INFLAMMATORY DISEASE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-12-17 US disclosed