SCHEMBL4565459

SCHEMBL4565459

O=C1CNC2(CCC(S(=O)(=O)c3ccc(-c4ccc5scnc5c4)cc3F)CC2)CC1C1CC1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
FASN P49327 2/20 0.33
HDAC4 P56524 1/20 0.30
KDM1A O60341 1/20 0.30
CHRM5 P08912 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 0.84 FASN (0.36) ALOX5APFEN1FASN
SCHEMBL4562348 0.80 KDM4E (0.31) FASN
SCHEMBL4565721 0.77 ALOX5AP (0.32) ALOX5APFEN1
SCHEMBL4564697 0.68 CHRNA7 (0.33) ALOX5APFASN
SCHEMBL4565426 0.68 TGFBR1 (0.38)
SCHEMBL4565379 0.67 IRAK4 (0.34) FASN
SCHEMBL4561087 0.67 LOXL2 (0.33) FASN
SCHEMBL4564399 0.67 FASN (0.37) FASN
SCHEMBL4565553 0.66 FGFR1 (0.37) KDM1A
SCHEMBL15543695 0.66 FASN (0.39) FASNKDM1A

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