SCHEMBL3962734

SCHEMBL3962734

CC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2)no1.Cc1ccc(S(=O)(=O)C(C)(C)C(=O)Nc2cc(C(C)(C)C)on2)cc1

nearest known ligand 0.91

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.91
CNR1 P21554 6/20 0.91
GAA P10253 1/20 0.60
HTT P42858 3/20 0.53
MAPT P10636 2/20 0.53
ATM Q13315 1/20 0.53
KMT2A Q03164 2/20 0.48
RAB9A P51151 2/20 0.48
MEN1 O00255 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MAPK14 Q16539 1/20 0.47
NPC1 O15118 1/20 0.46
PKM P14618 1/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
EGFR P00533 1/20 0.46

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
SCHEMBL469406 0.95 CNR2 (1.00) CNR2CNR1GAAHTTMAPT
SCHEMBL1465703 0.94 CNR2 (0.80) CNR2CNR1GAAHTTMAPT
SCHEMBL1463751 0.85 CNR2 (0.80) CNR2CNR1GAAHTTMAPT
SCHEMBL1464503 0.85 CNR2 (0.80) CNR2CNR1GAAHTTMAPT
SCHEMBL1464776 0.85 CNR2 (0.84) CNR2CNR1GAAHTTMAPT
SCHEMBL1463539 0.85 CNR2 (0.80) CNR2CNR1GAAHTTMAPT
SCHEMBL1464877 0.85 CNR2 (1.00) CNR2CNR1RAB9ANPC1TSHR
SCHEMBL1464681 0.84 CNR2 (0.79) CNR2CNR1GAAHTTMAPT
SCHEMBL1465645 0.84 CNR2 (0.79) CNR2CNR1GAAHTTMAPT
SCHEMBL766938 0.84 CNR2 (0.79) CNR2CNR1GAAHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2081905-B1 SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INT (DE) 2012-09-12 EP claimed
EP-2081905-A2 SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR Boehringer Ingelheim International GmbH (DE) 2009-07-29 EP claimed
WO-2008014199-A2 SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-01-31 WO claimed
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