SCHEMBL6603377

SCHEMBL6603377

Cc1oc(-c2ccccc2)nc1COc1ccc(C[C@H](N)C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.72
PPARG P37231 19/20 0.70
PPARA Q07869 14/20 0.70
PPARD Q03181 3/20 0.62

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
SCHEMBL5173961 0.91 PPARG (0.77) PPARGPPARAPPARD
Hydrochloric Acid SCHEMBL6276718 0.90 PPARG (0.75) PPARGPPARAPPARD
Hydrochloric Acid SCHEMBL6276712 0.90 PPARG (0.75) PPARGPPARAPPARD
SCHEMBL27568087 0.89 PPARG (0.71) PPARGPPARAPPARD
SCHEMBL6608605 0.89 PPARG (0.71) PPARGPPARAPPARD
SCHEMBL6603598 0.88 PPARG (0.58) FFAR1PPARGPPARAPPARD
SCHEMBL16470909 0.85 PPARG (0.81) FFAR1PPARGPPARAPPARD
SCHEMBL29691546 0.84 FFAR1 (0.70) FFAR1PPARGPPARAPPARD
SCHEMBL13206247 0.84 PPARG (0.74) PPARGPPARAPPARD
SCHEMBL13206269 0.84 PPARG (0.74) PPARGPPARAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1102757-B1 SUBSTITUTED OXAZOLE AND THIAZOLE DERIVATIVES AS HPPAR GAMMA AND HPPAR ALPHA ACTIVATORS GLAXO GROUP LTD (GB) 2004-04-14 EP disclosed
US-6498174-B1 AGONISTS TO PEROXISOME PROLIFERATOR-ACTIVATED RECEPTORS; MODULATING BLOOD GLUCOSE AND LIPID LEVELS; REDUCING DYSLIPIDEMIA AND HYPERINSULINEMIA ASSOCIATED WITH IMPAIRED GLUCOSE TOLERANCE OR METABOLIC SYNDROME SMITHKLINE BEECHAM CORPORATION 2002-12-24 US disclosed
EP-1102757-A1 SUBSTITUTED OXAZOLE AND THIAZOLE DERIVATIVES AS HPPAR GAMMA AND HPPAR ALPHA ACTIVATORS GLAXO GROUP LIMITED (GB) 2001-05-30 EP disclosed
WO-2000008002-A1 SUBSTITUTED OXAZOLES AND THIAZOLES DERIVATIVES AS hPPAR GAMMA AND hPPAR ALPHA ACTIVATORS GLAXO GROUP LIMITED (GB) 2000-02-17 WO disclosed