SCHEMBL3138316

SCHEMBL3138316

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

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 18/20 0.41
MAOB P27338 3/20 0.39
AKT1 P31749 1/20 0.39
KCNH2 Q12809 2/20 0.38
RCOR1 Q9UKL0 1/20 0.38
CHRNB2 P17787 1/20 0.37
CHRNA4 P43681 1/20 0.37
MAP4K4 O95819 1/20 0.37
MINK1 Q8N4C8 1/20 0.37
TNIK Q9UKE5 1/20 0.37

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
SCHEMBL3141821 0.92 KDM1A (0.41) KDM1AMAOBAKT1KCNH2RCOR1
SCHEMBL3151351 0.89 PTGDR2 (0.38)
SCHEMBL3155887 0.88 FFAR4 (0.36)
SCHEMBL3137211 0.88 FFAR4 (0.38) MAP4K4
SCHEMBL3150873 0.87 CYP11B1 (0.35)
SCHEMBL3146059 0.84 XDH (0.43) KDM1AAKT1KCNH2CHRNB2CHRNA4
SCHEMBL3151304 0.83 CYP11B1 (0.39)
SCHEMBL3260962 0.82 PTGDR2 (0.38) KDM1A
SCHEMBL3151485 0.81 SLC6A9 (0.37) CHRNB2CHRNA4MAP4K4
SCHEMBL3779591 0.80 EGLN1 (0.38) KDM1AMAOBAKT1KCNH2RCOR1

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