SCHEMBL4565405

SCHEMBL4565405

O=C1CNC2(CCC(S(=O)(=O)c3ccc(-c4ccc5cccc(F)c5c4)cc3)CC2)CC1C1CC1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 15/20 0.34
FASN P49327 3/20 0.34
PKM P14618 1/20 0.32
PKLR P30613 1/20 0.32

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
SCHEMBL4565553 0.80 FGFR1 (0.37)
SCHEMBL4564596 0.79 CD74 (0.34)
SCHEMBL4565577 0.78 SGK1 (0.46)
SCHEMBL4564691 0.77 FASN (0.36) FASN
SCHEMBL4536541 0.76
SCHEMBL4565426 0.75 TGFBR1 (0.38)
SCHEMBL4564399 0.75 FASN (0.37) FASN
SCHEMBL4562348 0.74 KDM4E (0.31) FASN
SCHEMBL4569982 0.74 PTPN1 (0.39) FASN
SCHEMBL4565379 0.73 IRAK4 (0.34) 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 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