SCHEMBL8448397

SCHEMBL8448397

Cc1cccc(C#Cc2ccc(S(=O)(=O)N[C@H](C)C(=O)O)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 6/20 0.58
ADAMTS4 O75173 2/20 0.56
MMP2 P08253 8/20 0.55
MMP13 P45452 5/20 0.55
MMP3 P08254 3/20 0.55
MMP1 P03956 1/20 0.50
MMP7 P09237 1/20 0.50
FFAR1 O14842 3/20 0.48
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
ALDH1A1 P00352 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 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
SCHEMBL8449004 0.87 MMP9 (0.75) MMP9ADAMTS4MMP2MMP13MMP3
SCHEMBL8450205 0.87 MMP9 (0.75) MMP9ADAMTS4MMP2MMP13MMP3
SCHEMBL8445778 0.82 ADAMTS4 (0.59) MMP9ADAMTS4MMP2MMP13MMP3
SCHEMBL7378828 0.81 ADAMTS4 (0.59) MMP9ADAMTS4MMP2MMP13MMP3
SCHEMBL8448908 0.80 ADAMTS4 (0.59) MMP9ADAMTS4MMP2MMP13MMP3
SCHEMBL8446616 0.80 ADAMTS4 (0.61) MMP9ADAMTS4MMP2MMP13MMP3
Hydrochloric Acid SCHEMBL7456085 0.80 ADAMTS4 (0.57) MMP9ADAMTS4MMP2MMP13MMP3
SCHEMBL8446569 0.78 ADAMTS4 (0.59) MMP9ADAMTS4MMP2MMP13MMP3
SCHEMBL4975578 0.78 ADAMTS4 (0.71) MMP9ADAMTS4MMP2MMP13MMP3
SCHEMBL698908 0.78 ADAMTS4 (0.71) MMP9ADAMTS4MMP2MMP13MMP3

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