SCHEMBL4077579

SCHEMBL4077579

CC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(S(C)(=O)=O)cc2)no1.CC(C)(C)c1cc(NC(=O)C(C)(C)S(=O)(=O)c2ccc3nsnc3c2)no1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 5/20 0.64
CNR1 P21554 3/20 0.64
GAA P10253 1/20 0.44
RET P07949 3/20 0.42
CSF1R P07333 2/20 0.42
NTRK1 P04629 2/20 0.42
KDR P35968 2/20 0.42
KCNH2 Q12809 1/20 0.42
CCDC6 Q16204 1/20 0.42
EGFR P00533 2/20 0.40
AURKA O14965 1/20 0.40
MAP4K4 O95819 1/20 0.40
AURKB Q96GD4 1/20 0.40
RAB9A P51151 4/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 3/20 0.39
MEN1 O00255 2/20 0.39
HTT P42858 4/20 0.39
MAPT P10636 3/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL1464717 0.95 CNR2 (0.67) CNR2CNR1GAAEGFRRAB9A
SCHEMBL1464503 0.89 CNR2 (0.80) CNR2CNR1GAARETCSF1R
SCHEMBL4076909 0.85 CNR2 (0.56) CNR2CNR1GAAEGFRRAB9A
SCHEMBL1463539 0.80 CNR2 (0.80) CNR2CNR1GAAEGFRRAB9A
SCHEMBL1464776 0.80 CNR2 (0.84) CNR2CNR1GAAEGFRRAB9A
SCHEMBL1465703 0.80 CNR2 (0.80) CNR2CNR1GAACSF1REGFR
SCHEMBL469406 0.79 CNR2 (1.00) CNR2CNR1GAAEGFRRAB9A
SCHEMBL1464383 0.79 CNR2 (0.78) CNR2CNR1GAAEGFRRAB9A
SCHEMBL766938 0.79 CNR2 (0.79) CNR2CNR1GAAEGFRRAB9A
SCHEMBL1465761 0.79 CNR2 (0.78) CNR2CNR1GAAEGFRRAB9A

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