SCHEMBL3958743

SCHEMBL3958743

CC(C)(C(=O)Nc1cccnc1)S(=O)(=O)c1ccc(C(F)(F)F)cc1.Cc1cnc(NC(=O)C(C)(C)S(=O)(=O)c2ccc(C(F)(F)F)cn2)s1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.50
CNR1 P21554 7/20 0.50
EPHX2 P34913 1/20 0.39
ABCC9 O60706 2/20 0.39
ABCC8 Q09428 2/20 0.39
KCNJ11 Q14654 2/20 0.39
KCNJ8 Q15842 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RORC P51449 1/20 0.38
NAMPT P43490 5/20 0.38

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
SCHEMBL12635235 0.86 CNR2 (0.59) CNR2CNR1EPHX2ABCC9ABCC8
SCHEMBL1464417 0.86 CNR2 (0.59) CNR2CNR1SMN1; SMN2
SCHEMBL1463718 0.84 CNR2 (0.58) CNR2CNR1SMN1; SMN2
SCHEMBL1465731 0.83 CNR2 (0.63) CNR2CNR1EPHX2ABCC9ABCC8
SCHEMBL1464572 0.73 NPC1 (0.56) ABCC9ABCC8KCNJ11KCNJ8SMN1; SMN2
SCHEMBL1464914 0.71 CYP1A2 (0.61) CNR2CNR1SMN1; SMN2NAMPT
SCHEMBL1464878 0.70 CNR2 (0.64) CNR2CNR1ABCC9ABCC8KCNJ11
SCHEMBL6285653 0.68 RAB9A (0.63) SMN1; SMN2NAMPT
SCHEMBL1465154 0.67 CNR2 (0.57) CNR2CNR1ABCC9ABCC8KCNJ11
SCHEMBL1464505 0.67 CNR2 (0.70) CNR2CNR1EPHX2ABCC9ABCC8

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 claimed
WO-2008014199-A2 SULFONYL COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-01-31 WO claimed