SCHEMBL3146674

SCHEMBL3146674

O=C(O)NCC1(COc2cnc(Cl)c(-c3ccc(Cl)cc3)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA7 P36544 1/20 0.43
FFAR4 Q5NUL3 5/20 0.41
MAP4K4 O95819 4/20 0.37
P2RX7 Q99572 2/20 0.37
EGLN1 Q9GZT9 4/20 0.36
EGLN3 Q9H6Z9 1/20 0.35

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
SCHEMBL3151015 0.93 FFAR4 (0.40) CHRNB4CHRNA3CHRNA7FFAR4P2RX7
SCHEMBL3147012 0.92 FFAR4 (0.44) CHRNB4CHRNA3CHRNA7FFAR4P2RX7
SCHEMBL3150641 0.92 P2RX7 (0.40) CHRNB4CHRNA3CHRNA7FFAR4P2RX7
SCHEMBL3256998 0.92 FFAR4 (0.42) CHRNB4CHRNA3CHRNA7FFAR4MAP4K4
SCHEMBL3147063 0.91 P2RX7 (0.44) CHRNB4CHRNA3CHRNA7FFAR4MAP4K4
SCHEMBL3150941 0.90 MALT1 (0.41) MAP4K4
SCHEMBL3147340 0.90 MAP4K4 (0.37) CHRNB4CHRNA3CHRNA7FFAR4MAP4K4
SCHEMBL3147051 0.90 FFAR4 (0.38) CHRNB4CHRNA3CHRNA7FFAR4P2RX7
SCHEMBL3137206 0.89 FFAR4 (0.38) CHRNB4CHRNA3CHRNA7FFAR4MAP4K4
SCHEMBL3151266 0.88 FFAR4 (0.38) CHRNB4CHRNA3CHRNA7FFAR4P2RX7

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