SCHEMBL6607542

SCHEMBL6607542

CCc1oc(-c2ccc(F)cc2)nc1CCCO

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.46
PPARA Q07869 8/20 0.46
PPARD Q03181 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK14 Q16539 2/20 0.37
TARBP2 Q15633 1/20 0.36
UTRN P46939 1/20 0.36
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
USP2 O75604 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
MAPT P10636 1/20 0.35

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 0.92 PPARG (0.42) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL6604633 0.86 PPARG (0.47) PPARGPPARAPPARDNPC1RAB9A
SCHEMBL6604396 0.85 MEN1 (0.43) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL6607539 0.78 MEN1 (0.42) MEN1KMT2ANPC1RAB9ATP53
SCHEMBL9910339 0.78 ESR2 (0.46) PPARGPPARAPPARDNPC1RAB9A
SCHEMBL18095687 0.78 PPARG (0.54) PPARGPPARAPPARDNPC1RAB9A
SCHEMBL18095717 0.78 PPARG (0.46) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL6605732 0.78 KDM4E (0.52) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL4478993 0.77 PPARG (0.44) PPARGPPARAPPARDUTRNALDH1A1
SCHEMBL6603331 0.77 PPARA (0.47) PPARGPPARAPPARDNPC1RAB9A

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 1 patent. 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