SCHEMBL8448908

SCHEMBL8448908

Cc1ccccc1C#Cc1ccc(S(=O)(=O)N[C@H](C)C(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 2/20 0.59
FFAR1 O14842 6/20 0.58
MMP9 P14780 5/20 0.55
MMP2 P08253 7/20 0.52
MMP13 P45452 5/20 0.52
MMP3 P08254 3/20 0.52
MMP1 P03956 1/20 0.50
MMP7 P09237 1/20 0.50
SLC16A3 O15427 2/20 0.48
CHRM2 P08172 1/20 0.48
S1PR1 P21453 1/20 0.48
FPR1 P21462 1/20 0.48
FPR3 P25089 1/20 0.48
GPR183 P32249 1/20 0.48
APLNR P35414 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
GPR65 Q8IYL9 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
SCHEMBL8450205 0.84 MMP9 (0.75) ADAMTS4MMP9MMP2MMP13MMP3
SCHEMBL8449004 0.84 MMP9 (0.75) ADAMTS4MMP9MMP2MMP13MMP3
SCHEMBL8450122 0.84 FFAR1 (0.49) ADAMTS4FFAR1MMP9MMP2MMP13
SCHEMBL8448397 0.80 MMP9 (0.58) ADAMTS4FFAR1MMP9MMP2MMP13
SCHEMBL8445778 0.80 ADAMTS4 (0.59) ADAMTS4MMP9MMP2MMP13MMP3
SCHEMBL8446616 0.80 ADAMTS4 (0.61) ADAMTS4MMP9MMP2MMP13MMP3
SCHEMBL8446569 0.78 ADAMTS4 (0.59) ADAMTS4MMP9MMP2MMP13MMP3
SCHEMBL702794 0.78 ADAMTS4 (0.81) ADAMTS4MMP9MMP2MMP13MMP3
SCHEMBL790069 0.78 ADAMTS4 (0.81) ADAMTS4MMP9MMP2MMP13MMP3
SCHEMBL702793 0.78 ADAMTS4 (0.81) ADAMTS4MMP9MMP2MMP13MMP3

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