SCHEMBL6604396

SCHEMBL6604396

CCc1oc(-c2ccc(F)cc2)nc1CO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TARBP2 Q15633 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
UTRN P46939 3/20 0.41
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
PPARD Q03181 1/20 0.41
GCGR P47871 1/20 0.40
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39
HTR2B P41595 1/20 0.39
TP53 P04637 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALOX15 P16050 1/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPT P10636 3/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL6608776 0.88 PPARG (0.42) MEN1KMT2ATARBP2NPC1RAB9A
SCHEMBL6607542 0.85 PPARG (0.46) MEN1KMT2ATARBP2NPC1RAB9A
SCHEMBL18003299 0.84 NOTUM (0.46) TARBP2UTRNPPARGPPARAPOLB
SCHEMBL6606425 0.84 KDM4E (0.49) KMT2ATARBP2NPC1RAB9APPARG
SCHEMBL6605732 0.82 KDM4E (0.52) MEN1KMT2ATARBP2RAB9APPARG
SCHEMBL5096428 0.81 ALDH1A1 (0.51) MEN1KMT2ANPC1RAB9APPARG
SCHEMBL9831294 0.78 NPC1 (0.44) MEN1KMT2ANPC1RAB9APPARG
SCHEMBL18003599 0.77 GCGR (0.46) NPC1RAB9AUTRNGCGRUSP2
SCHEMBL6602803 0.76 TARBP2 (0.52) MEN1KMT2ATARBP2UTRNPPARG
SCHEMBL12961041 0.76 ALDH1A1 (0.52) MEN1KMT2ANPC1RAB9APPARG

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