SCHEMBL3137211

SCHEMBL3137211

CN(C(=O)O)C1(COc2cnc(F)c(-c3ccc(Cl)cc3)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 9/20 0.38
CHRNB4 P30926 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA7 P36544 1/20 0.37
MAP4K4 O95819 3/20 0.36

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
SCHEMBL3147342 0.91 MAP4K4 (0.37) FFAR4CHRNB4CHRNA3CHRNA7MAP4K4
SCHEMBL3155887 0.90 FFAR4 (0.36) FFAR4
SCHEMBL3146681 0.89 CHRNB4 (0.45) FFAR4CHRNB4CHRNA3CHRNA7MAP4K4
SCHEMBL3151485 0.89 SLC6A9 (0.37) MAP4K4
SCHEMBL3150873 0.88 CYP11B1 (0.35) FFAR4
SCHEMBL3150947 0.88 MALT1 (0.42) MAP4K4
SCHEMBL3138316 0.88 KDM1A (0.41) MAP4K4
SCHEMBL3151304 0.84 CYP11B1 (0.39)
SCHEMBL3151018 0.82 FFAR4 (0.40) FFAR4CHRNB4CHRNA3CHRNA7
SCHEMBL3147019 0.82 FFAR4 (0.44) FFAR4CHRNB4CHRNA3CHRNA7

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-1979321-B9 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2010-02-17 EP disclosed
EP-1979321-B1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2009-07-29 EP disclosed