SCHEMBL4433247

SCHEMBL4433247

CCc1c(C(=O)O)nc(-c2ncccc2C)n1-c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.45
CNR2 P34972 3/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
POLB P06746 1/20 0.42
PABPC1 P11940 1/20 0.42
PDE4B Q07343 1/20 0.41
PDE4D Q08499 1/20 0.41
TRPV1 Q8NER1 1/20 0.40
ACHE P22303 2/20 0.39
MDM2 Q00987 1/20 0.38
GSR P00390 2/20 0.38
MYC P01106 1/20 0.37
USP14 P54578 1/20 0.37
GABRA2 P47869 1/20 0.36
GABRB2 P47870 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
SCHEMBL27759626 0.89 CNR1 (0.47) CNR1CNR2MEN1KMT2APOLB
SCHEMBL674185 0.82 CNR1 (0.56) CNR1CNR2PDE4BPDE4D
SCHEMBL738485 0.78 CNR1 (0.68) CNR1CNR2ACHE
SCHEMBL5594813 0.74 PTGS2 (0.55) CNR1CNR2
SCHEMBL4563362 0.73 TRPV1 (0.38) MEN1KMT2APOLBPDE4BPDE4D
SCHEMBL5594668 0.73 PTGS2 (0.55)
SCHEMBL4425643 0.73 CNR1 (0.61) CNR1CNR2
SCHEMBL4515557 0.71 CNR1 (0.65) CNR1CNR2
SCHEMBL4512131 0.70 CNR1 (0.66) CNR1CNR2PDE4BPDE4D
SCHEMBL764490 0.68 CNR1 (0.70) CNR1CNR2ACHE

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-2026798-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING CBX CANNABINOID RECEPTOR MODULATORS AND POTASSIUM CHANNEL MODULATORS Solvay Pharmaceuticals GmbH (DE) 2009-02-25 EP claimed
WO-2007125048-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING CBX CANNABINOID RECEPTOR MODULATORS AND POTASSIUM CHANNEL MODULATORS SOLVAY PHARMACEUTICALS GMBH (DE) 2007-11-08 WO claimed
CN-101431994-A Use of CBx cannabinoid receptor modulators as potassium channel modulators SOLVAY PHARM GMBH (DE) 2009-05-13 CN disclosed
CN-101431998-A Containing CBxPharmaceutical compositions of cannabinoid receptor modulators and potassium channel modulators SOLVAY PHARM GMBH (DE) 2009-05-13 CN disclosed