Niacinamide

Niacinamide

SCHEMBL4732897

Cc1ccc(C(=O)N2CCC(c3ccc(Cl)c(Cl)c3)CC2)cc1NC(=O)c1ccc(N2CCOCC2)nc1.NC(=O)c1cccnc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FASN P49327 19/20 0.60
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL4737589 0.91 FASN (0.67) FASN
SCHEMBL4734984 0.82 FASN (0.73) FASN
SCHEMBL4734907 0.80 FASN (0.71) FASN
SCHEMBL4731958 0.79 FASN (0.72) FASN
SCHEMBL4731203 0.79 FASN (0.87) FASN
SCHEMBL4782991 0.79 FASN (0.68) FASN
SCHEMBL4732716 0.79 FASN (0.70) FASNSMN1; SMN2
SCHEMBL16799500 0.77 FASN (0.65) FASN
SCHEMBL4737274 0.77 FASN (0.72) FASN
SCHEMBL4783675 0.77 FASN (0.87) FASN

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-2008059214-A1 BISAMLDE DERIVATIVES AND USE THEREOF AS FATTY ACID SYNTHASE INHIBITORS ASTRAZENECA AB (SE) 2008-05-22 WO claimed