SCHEMBL3967399

SCHEMBL3967399

CC(C)(C(=O)Nc1cccc(Cl)c1)S(=O)(=O)c1ccc(Cl)cc1.CC(C)(C(=O)Nc1ccccc1C(F)(F)F)S(=O)(=O)c1ccc(Cl)cc1.CC(C)(C(=O)Nc1ccccc1Cl)S(=O)(=O)c1ccc(Cl)cc1.CC(C)(C(=O)Nc1ccccn1)S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 12/20 0.55
▸ CNR1 P21554 5/20 0.47
▸ KMT2A Q03164 3/20 0.44
▸ MEN1 O00255 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ EEF2K O00418 1/20 0.39
▸ PLK1 P53350 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ GRM4 Q14833 1/20 0.39
▸ GRIK1 P39086 1/20 0.39

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
SCHEMBL1465187 0.80 CNR2 (0.65) CNR2CNR1KMT2AGRIK1
SCHEMBL3962868 0.80 CNR2 (0.43) CNR2CNR1KMT2AMEN1SMN1; SMN2
SCHEMBL1465749 0.79 CNR2 (0.61) CNR2CNR1KMT2AMEN1NPC1
SCHEMBL1464368 0.77 CNR2 (0.76) CNR2CNR1KMT2AMEN1
SCHEMBL1464824 0.75 CNR2 (0.59) CNR2CNR1
SCHEMBL1464953 0.73 CNR2 (0.60) CNR2CNR1
SCHEMBL1464492 0.72 CNR2 (1.00) CNR2CNR1KMT2AMEN1GRIK1
SCHEMBL1464599 0.72 CNR2 (0.56) CNR2CNR1
SCHEMBL1464687 0.71 CNR2 (0.67) CNR2CNR1NPC1RAB9A
SCHEMBL1464328 0.71 CNR2 (0.65) CNR2CNR1

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-2081905-A2 SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR Boehringer Ingelheim International GmbH (DE) 2009-07-29 — — EP disclosed
WO-2008014199-A2 SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-01-31 — — WO disclosed
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