SCHEMBL4733280

SCHEMBL4733280

Cc1ccc(C(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)cc1NC(=O)c1ccc(Cl)nc1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FASN P49327 16/20 0.69
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
EGLN1 Q9GZT9 1/20 0.47
PROKR1 Q8TCW9 1/20 0.47
KCNQ3 O43525 1/20 0.46
KCNQ2 O43526 1/20 0.46
KCNE1 P15382 1/20 0.46
KCNQ1 P51787 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
SCHEMBL4735905 0.90 FASN (0.63) FASNEGLN1PROKR1
SCHEMBL4737584 0.90 FASN (0.74) FASN
SCHEMBL4736239 0.90 FASN (0.74) FASN
SCHEMBL4737156 0.88 FASN (0.72) FASN
SCHEMBL4734375 0.88 FASN (0.66) FASNEGLN1PROKR1
SCHEMBL4733303 0.88 FASN (0.60) FASNEGLN1PROKR1
SCHEMBL16802696 0.88 FASN (0.69) FASN
SCHEMBL4731407 0.88 FASN (0.71) FASN
SCHEMBL4784807 0.87 FASN (0.70) FASN
SCHEMBL4731958 0.87 FASN (0.72) 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