SCHEMBL3455532

SCHEMBL3455532

Cc1nc(-c2c(O)cc[nH]c2=O)sc1C(=O)NCc1cccc(F)c1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCD O00767 14/20 0.60
CHRM4 P08173 1/20 0.49
MAOB P27338 1/20 0.44

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
SCHEMBL3454598 0.89 SCD (0.56) SCDCHRM4
SCHEMBL3454995 0.88 SCD (0.58) SCD
SCHEMBL3454999 0.88 SCD (0.59) SCDCHRM4MAOB
SCHEMBL3454983 0.84 SCD (0.48) SCDCHRM4
SCHEMBL3454982 0.83 SCD (0.50) SCDCHRM4MAOB
SCHEMBL3455448 0.81 SCD (0.58) SCD
SCHEMBL3454876 0.78 SCD (0.57) SCDCHRM4
SCHEMBL3454189 0.77 PPARA (0.55) SCD
SCHEMBL3454811 0.77 SCD (0.56) SCD
SCHEMBL3455044 0.77 SCD (0.58) SCD

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
WO-2007143597-A9 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2010-11-11 WO claimed