SCHEMBL4064696

SCHEMBL4064696

Cc1cnn(-c2cc(Cl)ccc2Cl)c(=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.46
OPRM1 P35372 1/20 0.43
THRB P10828 1/20 0.43
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PDE9A O76083 1/20 0.42
MAPT P10636 1/20 0.41
CDK4 P11802 1/20 0.41
CCND1 P24385 1/20 0.41
PDE2A O00408 1/20 0.39
LMNA P02545 1/20 0.39
ALOX12 P18054 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
NOTUM Q6P988 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
PAX8 Q06710 1/20 0.38
FGFR1 P11362 1/20 0.37
SRC P12931 1/20 0.37
FGFR2 P21802 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
SCHEMBL1750717 0.81 HTT (0.43) HTTOPRM1THRBKDM4EL3MBTL1
SCHEMBL1750445 0.81 NPBWR1 (0.44) HTTOPRM1KDM4EMAPTLMNA
SCHEMBL7754483 0.77 MAPT (0.35) HTTMAPTLMNAALOX12NPSR1
SCHEMBL4062470 0.75 NPBWR1 (0.42) CDK4CCND1LMNANPC1RAB9A
SCHEMBL4063236 0.75 HTT (0.43) HTTOPRM1THRBKDM4EL3MBTL1
SCHEMBL11724179 0.74 HTT (0.54) HTTOPRM1THRBKDM4EL3MBTL1
SCHEMBL7755931 0.73 PKM (0.43) HTTL3MBTL1MAPTLMNANPSR1
SCHEMBL1750412 0.71 MAPT (0.50) HTTOPRM1THRBKDM4EL3MBTL1
SCHEMBL11734120 0.69 KMT2A (0.50) HTTOPRM1THRBKDM4EL3MBTL1
SCHEMBL1749799 0.69 RAB9A (0.54) HTTL3MBTL1MAPTLMNANPSR1

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
EP-2123264-A1 Heterocyclic derivatives as abnormal cannabidiols agents for lowering intraocular pressure Allergan, Inc. (US) 2009-11-25 EP claimed