SCHEMBL4565737

SCHEMBL4565737

O=C1CNC2(CCC(S(=O)(=O)c3ccc(-c4ccc5cccnc5c4)cn3)CC2)CC1C1CC1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.37
FASN P49327 6/20 0.36
LOXL2 Q9Y4K0 2/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
MAPK14 Q16539 1/20 0.30

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
SCHEMBL4564691 0.87 FASN (0.36) GSK3BFASNDDB1CRBN
SCHEMBL4565609 0.85 FASN (0.38) GSK3BFASNDDB1CRBN
SCHEMBL4564697 0.85 CHRNA7 (0.33) FASN
SCHEMBL4564399 0.85 FASN (0.37) GSK3BFASNLOXL2DDB1CRBN
SCHEMBL4565347 0.82 MAPK14 (0.35) GSK3BFASNDDB1CRBNMAPK14
SCHEMBL4565605 0.82 MAPK14 (0.37) GSK3BFASNLOXL2DDB1CRBN
SCHEMBL4564893 0.81 FASN (0.35) GSK3BFASNLOXL2MAPK14
SCHEMBL4561087 0.81 LOXL2 (0.33) GSK3BFASNLOXL2DDB1CRBN
SCHEMBL4564364 0.80 HTR6 (0.36) GSK3BFASNLOXL2MAPK14
SCHEMBL4561931 0.78 FASN (0.41) GSK3BFASNLOXL2DDB1CRBN

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2637660-A1 FATTY ACID SYNTHASE INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2013-09-18 EP disclosed
WO-2012064642-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-05-18 WO disclosed