SCHEMBL8450205

SCHEMBL8450205

Cc1ccc(C#Cc2ccc(S(=O)(=O)N[C@@H](C)C(=O)O)cc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 9/20 0.75
MMP2 P08253 11/20 0.62
MMP13 P45452 6/20 0.62
MMP3 P08254 5/20 0.62
ADAMTS4 O75173 1/20 0.60
MMP1 P03956 4/20 0.57
MMP7 P09237 4/20 0.57
SLC1A3 P43003 1/20 0.54
SLC1A2 P43004 1/20 0.54
SLC1A1 P43005 1/20 0.54
TSHR P16473 1/20 0.50
HTT P42858 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CA12 O43570 2/20 0.49
CA9 Q16790 2/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA14 Q9ULX7 1/20 0.48

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
SCHEMBL8449004 1.00 MMP9 (0.75) MMP9MMP2MMP13MMP3ADAMTS4
SCHEMBL698907 0.91 ADAMTS4 (0.71) MMP9MMP2MMP13MMP3ADAMTS4
SCHEMBL698908 0.91 ADAMTS4 (0.71) MMP9MMP2MMP13MMP3ADAMTS4
SCHEMBL4975578 0.91 ADAMTS4 (0.71) MMP9MMP2MMP13MMP3ADAMTS4
Water SCHEMBL29881522 0.89 ADAMTS4 (0.69) MMP9MMP2MMP13MMP3ADAMTS4
SCHEMBL8448397 0.87 MMP9 (0.58) MMP9MMP2MMP13MMP3ADAMTS4
SCHEMBL8446616 0.87 ADAMTS4 (0.61) MMP9MMP2MMP13MMP3ADAMTS4
SCHEMBL8446641 0.86 MMP9 (0.64) MMP9MMP2MMP13MMP3MMP1
SCHEMBL8446571 0.86 MMP9 (0.64) MMP9MMP2MMP13MMP3MMP1
SCHEMBL8446281 0.86 MMP9 (1.00) MMP9MMP2MMP13MMP3ADAMTS4

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-0915086-A1 PHENYLSULFONAMIDE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1999-05-12 EP claimed
EP-0915086-A1 PHENYLSULFONAMIDE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 1999-05-12 EP disclosed