SCHEMBL13664858

SCHEMBL13664858

O=CCNCC1(CNc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.38
MEN1 O00255 6/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 2/20 0.38
USP2 O75604 1/20 0.37
MAPT P10636 4/20 0.36
LMNA P02545 3/20 0.36
HTT P42858 2/20 0.36
MCL1 Q07820 1/20 0.36
POLB P06746 2/20 0.36
EPHX1 P07099 2/20 0.36
EPHX2 P34913 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
CHRM1 P11229 1/20 0.36
SLC6A2 P23975 1/20 0.36
PDE4A P27815 1/20 0.36
ADRA1A P35348 1/20 0.36
OPRM1 P35372 1/20 0.36
PDE3A Q14432 1/20 0.36
NLRP3 Q96P20 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
SCHEMBL13664688 0.70 KMT2A (0.42) KMT2AMEN1NPC1RAB9AUSP2
SCHEMBL13665269 0.70 CYP3A4 (0.39) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL13664855 0.70 POLB (0.40) KMT2AMEN1NPC1MAPTLMNA
SCHEMBL13664887 0.66 KCNH2 (0.41) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL11651664 0.64 MEN1 (0.52) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL9618277 0.64 CA2 (0.46) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL10779663 0.64 NPC1 (0.41) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL13664860 0.63 MMP8 (0.41) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL20714819 0.62 MAPT (0.50) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL244815 0.61 EPHX1 (0.52) KMT2AMEN1NPC1RAB9AMAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009119528-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-10-01 WO disclosed