SCHEMBL16365082

SCHEMBL16365082

CCC(=O)N[C@@H]1CC[C@H](N(C)C(=O)c2ccc(-c3ccc4[nH]ncc4c3)cc2)C1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ FASN P49327 19/20 0.68
▸ MAPK14 Q16539 1/20 0.48

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
SCHEMBL16324232 1.00 FASN (0.68) FASNMAPK14
SCHEMBL16365757 0.93 FASN (0.68) FASN
SCHEMBL16324411 0.93 FASN (0.68) FASN
SCHEMBL18924558 0.93 FASN (0.68) FASN
SCHEMBL17739730 0.93 FASN (0.68) FASN
SCHEMBL16323223 0.89 FASN (0.83) FASNMAPK14
SCHEMBL16324462 0.88 FASN (0.63) FASN
SCHEMBL16365086 0.85 FASN (0.65) FASN
SCHEMBL16323494 0.85 FASN (0.65) FASN
SCHEMBL16323722 0.84 FASN (0.63) 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-2014202168-A1 1,3-DIAMINOCYCLOPENTANE CARBOXAMIDE DERIVATIVES MERCK PATENT GMBH (DE) 2014-12-24 — — WO disclosed
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