SCHEMBL3156236

SCHEMBL3156236

O=C(O)NCC1(CNc2cnc(Cl)c(Br)c2)CC1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
SYK P43405 1/20 0.31
KCNH2 Q12809 1/20 0.31
METAP2 P50579 1/20 0.31
HTT P42858 1/20 0.30
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 1/20 0.30

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
SCHEMBL3154902 0.86 SYK (0.34) SYKKCNH2
SCHEMBL3146187 0.80 MAP4K4 (0.38)
SCHEMBL3143340 0.79 ADORA2B (0.34)
SCHEMBL3765795 0.79 ALDH1A1 (0.31) ALDH1A1LMNA
SCHEMBL3151317 0.79 P2RX7 (0.35)
SCHEMBL4818188 0.78 KCNQ3 (0.43) ALDH1A1
SCHEMBL3145935 0.78 POLB (0.37) ALDH1A1GAAKMT2AHTT
SCHEMBL4821912 0.78 FPR2 (0.39) ALDH1A1KMT2A
SCHEMBL3141921 0.77 KMT2A (0.32) ALDH1A1KMT2ALMNAHTT
SCHEMBL3152373 0.76 EGLN1 (0.41)

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 4 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
EP-1979321-A1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Les Laboratoires Servier (FR) 2008-10-15 EP disclosed
WO-2007085750-A1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LES LABORATOIRES SERVIER (FR) 2007-08-02 WO disclosed