SCHEMBL4606805

SCHEMBL4606805

COC(=O)c1cccc(C(=O)Nc2ccc([C@@H]3CCC[C@@H]3NS(=O)(=O)C(C)C)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 13/20 0.55
GRIA2 P42262 4/20 0.53
KDM4E B2RXH2 1/20 0.46
KDM6B O15054 1/20 0.46
MAOB P27338 1/20 0.46
KDM5C P41229 1/20 0.46
KDM4C Q9H3R0 1/20 0.46
KDM2A Q9Y2K7 1/20 0.46
KDM3A Q9Y4C1 1/20 0.46
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KCNH2 Q12809 2/20 0.43

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
SCHEMBL4607477 0.90 GRIA4 (0.57) GRIA4GRIA2KCNH2
SCHEMBL4607636 0.90 GRIA4 (0.57) GRIA4GRIA2KCNH2
SCHEMBL4605760 0.90 GRIA4 (0.58) GRIA4GRIA2KDM4EMEN1NPC1
SCHEMBL4605766 0.90 GRIA4 (0.58) GRIA4GRIA2KDM4EMEN1NPC1
SCHEMBL4605829 0.87 GRIA4 (0.56) GRIA4GRIA2MAOBKCNH2
SCHEMBL4607371 0.87 GRIA4 (0.56) GRIA4GRIA2MAOBKCNH2
SCHEMBL4607600 0.87 GRIA4 (0.70) GRIA4GRIA2MAOB
SCHEMBL4607075 0.87 GRIA4 (0.70) GRIA4GRIA2MAOB
SCHEMBL4605831 0.86 GRIA4 (0.55) GRIA4GRIA2KCNH2
SCHEMBL4605833 0.86 GRIA4 (0.55) GRIA4GRIA2KCNH2

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-1246797-B1 CYCLOPENTYL SULFONAMIDE DERIVATIVES LILLY CO ELI (US) 2008-07-23 EP claimed
EP-1246797-B1 CYCLOPENTYL SULFONAMIDE DERIVATIVES LILLY CO ELI (US) 2008-07-23 EP disclosed