SCHEMBL6603353

SCHEMBL6603353

CCc1sc(-c2ccccc2)nc1CCO

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.52
PTGDR2 Q9Y5Y4 3/20 0.47
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
ALOX5 P09917 3/20 0.44
TRPM8 Q7Z2W7 1/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL6603517 0.87 L3MBTL1 (0.58) L3MBTL1PTGDR2KDM4EPOLBTRPM8
SCHEMBL18015850 0.85 L3MBTL1 (0.55) L3MBTL1PTGDR2KDM4EPOLBTRPM8
SCHEMBL6602682 0.85 DCK (0.55) PTGDR2TRPM8MAPT
SCHEMBL4469407 0.81 FFAR1 (0.46) KDM4EALDH1A1MAPT
SCHEMBL1436076 0.81 RARA (0.50) ALOX5ALDH1A1MAPT
SCHEMBL6608210 0.80 PTGDR2 (0.63) L3MBTL1PTGDR2KDM4EPOLBTRPM8
SCHEMBL18014741 0.78 L3MBTL1 (0.49) L3MBTL1PTGDR2KDM4EPOLBTRPM8
SCHEMBL4889434 0.78 RARA (0.51) PTGDR2ALOX5ALDH1A1MAPT
SCHEMBL260421 0.78 LMNA (0.54) PTGDR2KDM4EPOLBALDH1A1MAPT
SCHEMBL9628554 0.77 TRPM8 (0.62) L3MBTL1PTGDR2ALOX5TRPM8MAPT

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