SCHEMBL4563433

SCHEMBL4563433

CCc1cnc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
CNR1 P21554 6/20 0.49
CNR2 P34972 3/20 0.49
MEN1 O00255 1/20 0.48
HSD11B1 P28845 2/20 0.48
POLB P06746 1/20 0.47
OPRL1 P41146 1/20 0.45
KCNH2 Q12809 1/20 0.44

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
SCHEMBL4562967 0.92 CNR1 (0.44) KMT2ACNR1CNR2MEN1POLB
SCHEMBL3683921 0.92 KMT2A (0.52) KMT2ACNR1CNR2MEN1HSD11B1
SCHEMBL4562966 0.87 KMT2A (0.49) KMT2ACNR1CNR2MEN1HSD11B1
SCHEMBL4563366 0.84 KMT2A (0.54) KMT2ACNR1CNR2MEN1HSD11B1
SCHEMBL4563669 0.83 CNR1 (0.46) KMT2ACNR1CNR2MEN1HSD11B1
SCHEMBL4563605 0.82 KMT2A (0.47) KMT2ACNR1CNR2MEN1HSD11B1
SCHEMBL12064374 0.76 CNR1 (0.47) KMT2ACNR1CNR2MEN1HSD11B1
SCHEMBL4563346 0.74 KMT2A (0.47) KMT2ACNR1CNR2MEN1HSD11B1
SCHEMBL5141889 0.74 CNR1 (0.50) KMT2ACNR1CNR2MEN1HSD11B1
SCHEMBL12064305 0.73 POLB (0.43) KMT2ACNR1CNR2MEN1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2026798-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING CBX CANNABINOID RECEPTOR MODULATORS AND POTASSIUM CHANNEL MODULATORS Solvay Pharmaceuticals GmbH (DE) 2009-02-25 EP disclosed
WO-2007125048-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING CBX CANNABINOID RECEPTOR MODULATORS AND POTASSIUM CHANNEL MODULATORS SOLVAY PHARMACEUTICALS GMBH (DE) 2007-11-08 WO disclosed