SCHEMBL6603331

SCHEMBL6603331

CCc1oc(-c2ccccc2)nc1CCO

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.47
PPARG P37231 9/20 0.47
PPARD Q03181 2/20 0.47
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TARBP2 Q15633 2/20 0.42
HRH3 Q9Y5N1 1/20 0.42
HPGD P15428 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
KDR P35968 1/20 0.40
MAPT P10636 1/20 0.39
NOTUM Q6P988 1/20 0.39

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
SCHEMBL6604633 0.91 PPARG (0.47) PPARAPPARGPPARDKDM4ENPC1
SCHEMBL5111146 0.89 PPARA (0.48) PPARAPPARGPPARDKDM4ENPC1
SCHEMBL26062737 0.87 PPARG (0.47) PPARAPPARGPPARDKDM4ENPC1
SCHEMBL6606425 0.87 KDM4E (0.49) PPARAPPARGPPARDKDM4ENPC1
SCHEMBL9910339 0.86 ESR2 (0.46) PPARAPPARGPPARDNPC1RAB9A
SCHEMBL18095717 0.86 PPARG (0.46) PPARAPPARGPPARDKDM4ENPC1
SCHEMBL18095687 0.86 PPARG (0.54) PPARAPPARGPPARDKDM4ENPC1
SCHEMBL13960245 0.85 KDM4E (0.49) PPARAPPARGPPARDKDM4ENPC1
SCHEMBL6608776 0.85 PPARG (0.42) PPARAPPARGPPARDNPC1RAB9A
SCHEMBL18103290 0.82 TARBP2 (0.56) PPARAPPARGPPARDKDM4ENPC1

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