SCHEMBL3455044

SCHEMBL3455044

Cc1nc(-c2c(NCc3ccccc3)cc[nH]c2=O)sc1C(=O)NCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 14/20 0.58
NPC1 O15118 1/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL3454995 0.88 SCD (0.58) SCDNPC1HPGD
SCHEMBL3454876 0.87 SCD (0.57) SCDNPC1HPGDSMN1; SMN2
SCHEMBL3454811 0.86 SCD (0.56) SCDNPC1HPGDSMN1; SMN2
SCHEMBL3454229 0.85 SCD (0.55) SCDNPC1HPGD
SCHEMBL3455924 0.85 SCD (0.56) SCDNPC1HPGD
SCHEMBL3454189 0.84 PPARA (0.55) SCDNPC1HPGD
SCHEMBL3454779 0.83 SCD (0.53) SCDNPC1HPGDSMN1; SMN2
SCHEMBL3455689 0.83 SCD (0.53) SCDNPC1HPGD
SCHEMBL3454977 0.83 SCD (0.54) SCDNPC1HPGD
SCHEMBL3455858 0.83 SCD (0.54) SCDNPC1HPGD

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