SCHEMBL2355763

SCHEMBL2355763

CC(C)(C)C1[C@H](Cc2n[nH]c(=O)n2-c2ccc(-c3ccc4cccnc4c3)cc2F)CCN1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FASN P49327 13/20 0.46
GSK3B P49841 1/20 0.36
GPER1 Q99527 2/20 0.34
PDE4B Q07343 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
MAPK8 P45983 1/20 0.32
MAPK9 P45984 1/20 0.32
MAPK10 P53779 1/20 0.32
CFD P00746 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
SCHEMBL2357731 0.89 FASN (0.44) FASNGSK3BMAPK8MAPK9MAPK10
SCHEMBL2356332 0.87 FASN (0.49) FASN
SCHEMBL2357335 0.85 FASN (0.61) FASN
SCHEMBL2358391 0.84 FASN (0.53) FASN
SCHEMBL2355152 0.82 FASN (0.42) FASN
SCHEMBL14151542 0.81 FASN (0.65) FASNGSK3B
SCHEMBL2298115 0.80 FASN (0.61) FASN
SCHEMBL2298123 0.80 FASN (0.61) FASN
SCHEMBL14227287 0.79 FASN (0.64) FASN
SCHEMBL2299747 0.78 FASN (0.61) 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-2011103546-A1 TRIAZOLONES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-08-25 WO disclosed