SCHEMBL6603598

SCHEMBL6603598

CCc1oc(-c2ccccc2)nc1COc1ccc(C[C@H](N)C(=O)O)cc1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.58
PPARA Q07869 15/20 0.58
FFAR1 O14842 1/20 0.56
PPARD Q03181 3/20 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
SCHEMBL6603216 0.92 PPARG (0.60) PPARGPPARAPPARD
SCHEMBL6604295 0.91 PPARG (0.60) PPARGPPARAFFAR1PPARD
SCHEMBL27547897 0.90 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL6609370 0.90 PPARG (0.56) PPARGPPARAPPARD
SCHEMBL6603377 0.88 FFAR1 (0.72) PPARGPPARAFFAR1PPARD
SCHEMBL6603469 0.85 PPARG (0.60) PPARGPPARAPPARD
SCHEMBL6606105 0.84 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL6603556 0.82 PPARG (0.57) PPARGPPARAPPARD
SCHEMBL5173961 0.81 PPARG (0.77) PPARGPPARAPPARD
Hydrochloric Acid SCHEMBL6276712 0.80 PPARG (0.75) 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