SCHEMBL3660182

SCHEMBL3660182

N#Cc1cccnc1OCCl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
SSTR4 P31391 1/20 0.40
L3MBTL1 Q9Y468 4/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 5/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP11B2 P19099 1/20 0.39
LRRK2 Q5S007 1/20 0.39
KDM4D Q6B0I6 1/20 0.37
ALDH1A1 P00352 5/20 0.37
DRD2 P14416 3/20 0.37
HTR2A P28223 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 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
SCHEMBL3432978 0.86 NPC1 (0.43) NPC1RAB9ASSTR4L3MBTL1GAA
SCHEMBL3803808 0.86 NPC1 (0.43) NPC1RAB9ASSTR4L3MBTL1GAA
SCHEMBL249966 0.81 L3MBTL1 (0.49) NPC1RAB9ASSTR4L3MBTL1GAA
SCHEMBL564714 0.79 HPGD (0.43) NPC1RAB9ASSTR4L3MBTL1GAA
SCHEMBL19999908 0.79 SSTR4 (0.39) NPC1RAB9ASSTR4L3MBTL1GAA
SCHEMBL3082319 0.77 ALDH1A1 (0.48) NPC1RAB9ASSTR4L3MBTL1GAA
SCHEMBL3287339 0.77 SSTR4 (0.46) NPC1RAB9ASSTR4HPGDCYP1A2
SCHEMBL22470618 0.77 SSTR4 (0.46) SSTR4HTR2AKDM4EALOX5APFEN1
SCHEMBL4034458 0.77 MAOB (0.51) NPC1RAB9AL3MBTL1CYP3A4
SCHEMBL8776855 0.77 MKNK1 (0.43) SSTR4HPGDCYP1A2CYP2D6CYP2C9

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-2231663-A2 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AS C-MET INHIBITORS Amgen, Inc (US) 2010-09-29 EP disclosed
WO-2009091374-A2 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2009-07-23 WO disclosed
US-4374140-A 2-Substituted propoxy-3-cyano-5-hydroxypyridines and use as antihypertensives MERCK & CO., INC. (US) 1983-02-15 US disclosed
US-4329351-A 2-Substituted propoxy-3-cyano-5-RO-pyridines and intermediates MERCK & CO., INC. (US) 1982-05-11 US disclosed