SCHEMBL2637655

SCHEMBL2637655

Cc1ccc(NC(=O)c2c(=O)[nH]n3c(=O)cc(-c4cccc(Cl)c4)[nH]c23)cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPK10 P53779 2/20 0.41
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
KCNQ3 O43525 2/20 0.39
KCNQ2 O43526 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KCNE1 P15382 1/20 0.39
KCNQ1 P51787 1/20 0.39
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.37
KDM4A O75164 1/20 0.37
KDM5A P29375 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
KDM5B Q9UGL1 1/20 0.37
GHSR Q92847 1/20 0.36
TP53 P04637 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
SCHEMBL2637533 0.87 MAPT (0.50) MEN1KMT2AMAPTTP53POLB
SCHEMBL2637207 0.85 CNR2 (0.45) NPC1RAB9AMEN1KMT2AMAPK10
SCHEMBL2637763 0.84 ALDH1A1 (0.51) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL2637430 0.83 NPC1 (0.48) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL2637506 0.81 MEN1 (0.40) NPC1RAB9AMEN1KMT2AKDM4A
SCHEMBL2637448 0.81 NPC1 (0.46) NPC1RAB9AMEN1KMT2AKDM4A
SCHEMBL2637260 0.81 CNR2 (0.50) NPC1RAB9AMEN1KMT2ACNR2
SCHEMBL2637493 0.80 NHERF1 (0.46) NPC1RAB9AMEN1KMT2ACNR2
SCHEMBL2637737 0.80 NPC1 (0.43) NPC1RAB9AMAPT
SCHEMBL2637188 0.79 MGAM (0.50) NPC1RAB9AMEN1KMT2AMAPT

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-2438070-A1 GLYCINE B ANTAGONISTS Merz Pharma GmbH & Co. KGaA (DE) 2012-04-11 EP claimed
WO-2010139483-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO. KGAA (DE) 2010-12-09 WO claimed
EP-2438070-A1 GLYCINE B ANTAGONISTS Merz Pharma GmbH & Co. KGaA (DE) 2012-04-11 EP disclosed
WO-2010139483-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO. KGAA (DE) 2010-12-09 WO disclosed