SCHEMBL4734404

SCHEMBL4734404

CCCN(C)CC(=O)Nc1cc(C(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)ccc1C

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FASN P49327 16/20 0.45
PROKR1 Q8TCW9 2/20 0.42
CNR1 P21554 1/20 0.42
EGLN1 Q9GZT9 1/20 0.41

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
SCHEMBL4786265 0.95 FASN (0.44) FASNPROKR1CNR1EGLN1
SCHEMBL4731303 0.94 FASN (0.46) FASNPROKR1CNR1EGLN1
SCHEMBL4734896 0.93 FASN (0.45) FASNPROKR1CNR1EGLN1
SCHEMBL4731986 0.87 FASN (0.46) FASNPROKR1CNR1EGLN1
SCHEMBL4732265 0.85 FASN (0.46) FASNPROKR1CNR1
SCHEMBL4735989 0.85 ALDH1A1 (0.43) FASNPROKR1CNR1
SCHEMBL4734716 0.85 FASN (0.49) FASNPROKR1CNR1EGLN1
SCHEMBL4191343 0.83 FASN (0.46) FASNPROKR1EGLN1
SCHEMBL4733770 0.82 FASN (0.51) FASNPROKR1EGLN1
SCHEMBL4736874 0.82 FASN (0.53) FASNPROKR1EGLN1

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