SCHEMBL4734871

SCHEMBL4734871

COc1ccc(C2CCN(C(=O)c3ccc(C(F)(F)F)c(NC(=O)c4ccc(N(C)C)nc4)c3)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FASN P49327 10/20 0.48
PROKR1 Q8TCW9 5/20 0.48
SFRP1 Q8N474 1/20 0.46
SLC9A1 P19634 1/20 0.46
PRSS12 P56730 1/20 0.45
EGLN1 Q9GZT9 1/20 0.44
HSD11B1 P28845 1/20 0.43

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
SCHEMBL4784490 0.89 FASN (0.56) FASNSFRP1SLC9A1PRSS12EGLN1
SCHEMBL4735650 0.89 FASN (0.61) FASNPROKR1
SCHEMBL4735674 0.84 FASN (0.59) FASNPROKR1
SCHEMBL4733303 0.83 FASN (0.60) FASNPROKR1EGLN1
SCHEMBL4786310 0.83 FASN (0.61) FASNPROKR1
SCHEMBL4735576 0.80 FASN (0.60) FASNEGLN1
SCHEMBL4735716 0.78 FASN (0.61) FASNPROKR1
SCHEMBL4733279 0.78 FASN (0.62) FASNPROKR1
SCHEMBL4784807 0.77 FASN (0.70) FASNPRSS12
SCHEMBL4734574 0.76 FASN (0.58) 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