SCHEMBL6487058

SCHEMBL6487058

Cc1oc(-c2ccc(F)cc2)nc1COc1cccc2cc(NS(=O)(=O)C(F)(F)F)ccc12

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.44
HSPE1 P61604 1/20 0.44
TP53 P04637 2/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 3/20 0.41
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40

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
SCHEMBL6484306 0.94 KDR (0.44) HSPD1HSPE1MAPTCYSLTR2CYSLTR1
SCHEMBL6477587 0.93 HSPD1 (0.43) HSPD1HSPE1TP53MAPTPPARG
SCHEMBL6487120 0.81 CYSLTR2 (0.44) CYSLTR2CYSLTR1
SCHEMBL9721974 0.80 KDR (0.58) TP53POLBMAPTPPARGPPARA
SCHEMBL9721949 0.79 MAPT (0.58) TP53POLBMAPTPPARGPPARA
SCHEMBL6476719 0.79 CYSLTR2 (0.49) HSPD1HSPE1CYSLTR2CYSLTR1
SCHEMBL6476535 0.79 CYSLTR2 (0.40) CYSLTR2CYSLTR1
SCHEMBL6488956 0.79 AGXT (0.42) CYSLTR2CYSLTR1
SCHEMBL6484697 0.79 PPARA (0.49) TP53MAPTPPARACYSLTR2CYSLTR1
SCHEMBL6485332 0.78 CYSLTR2 (0.41) CYSLTR2CYSLTR1

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
US-6933322-B2 Substituted naphthylenes for the treatment of non-insulin dependent diabetes mellitus WYETH (US) 2005-08-23 US disclosed