SCHEMBL4781007

SCHEMBL4781007

COc1ccc(C(=O)N2CCC(c3ccc(C#N)cc3)CC2)cc1NC(=O)c1ccc(=O)[nH]c1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FASN P49327 18/20 0.54
POLB P06746 1/20 0.50

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
SCHEMBL4735394 0.89 FASN (0.66) FASN
SCHEMBL4786470 0.86 LMNA (0.63) FASN
SCHEMBL4782164 0.83 FASN (0.55) FASN
SCHEMBL4736246 0.83 FASN (0.59) FASN
SCHEMBL4735392 0.81 FASN (0.65) FASN
SCHEMBL4194951 0.81 FASN (0.61) FASN
SCHEMBL4177644 0.81 FASN (0.75) FASN
SCHEMBL14210044 0.78 FASN (0.49) FASN
SCHEMBL4198213 0.78 FASN (0.56) FASN
SCHEMBL4734941 0.78 FASN (0.53) 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 disclosed