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SCHEMBL3968259

SCHEMBL3968259

CC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2)[nH]n1.CC(C)(C)c1coc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(Cl)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 17/20 0.51
▸ CNR1 P21554 8/20 0.51
▸ RORC P51449 1/20 0.36
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ MAPK14 Q16539 1/20 0.33

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
SCHEMBL1463777 0.90 CNR2 (0.58) CNR2CNR1RORCLMNAMAPT
SCHEMBL1464542 0.89 CNR2 (0.62) CNR2CNR1LMNAMAPTHTT
SCHEMBL12827987 0.75 CNR2 (0.52) CNR2CNR1RORCLMNAMAPT
SCHEMBL12827794 0.75 CNR2 (0.54) CNR2CNR1LMNAMAPTHTT
SCHEMBL1463796 0.74 CNR2 (0.52) CNR2CNR1RORC
SCHEMBL1464683 0.73 CNR2 (0.46) CNR2CNR1
SCHEMBL3968903 0.73 CNR2 (0.63) CNR2CNR1LMNAMAPTHTT
SCHEMBL3967650 0.72 CNR2 (0.50) CNR2CNR1MAPT
SCHEMBL1465418 0.70 CNR2 (0.43) CNR2CNR1
SCHEMBL1465550 0.70 CNR2 (0.67) CNR2CNR1MAPK14

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