SCHEMBL8446558

SCHEMBL8446558

C#Cc1ccc(S(=O)(=O)N(C)[C@H](CCC(=O)N(C)c2ccccc2)C(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 1/20 0.44
▸ ADAMTS4 O75173 1/20 0.39
▸ CYP2C9 P11712 3/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP8 P22894 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ POLQ O75417 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LIMK2 P53671 1/20 0.37
▸ ESR1 P03372 3/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ TSHR P16473 1/20 0.34

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
SCHEMBL8448904 0.89 DUT (0.44) CYP2C9MMP2MMP9MMP8MMP13
SCHEMBL28758085 0.75 ADAMTS5 (0.52) ADAMTS5ADAMTS4MMP2MMP9MMP8
SCHEMBL27642228 0.75 ADAMTS5 (0.52) ADAMTS5ADAMTS4MMP2MMP9MMP8
SCHEMBL28171647 0.73 ADAMTS5 (0.50) ADAMTS5ADAMTS4MMP2MMP9KMT2A
SCHEMBL8448898 0.72 MMP9 (0.35) ADAMTS5ADAMTS4CYP2C9MMP2MMP9
SCHEMBL8446545 0.71 ADAMTS4 (0.48) ADAMTS5ADAMTS4CYP2C9MMP9MMP13
SCHEMBL8837620 0.71 CA12 (0.65) LIMK2KMT2ATSHR
SCHEMBL19953661 0.70 POLQ (0.49) CYP2C9POLQALDH1A1KMT2ATP53
SCHEMBL600070 0.69 ADAMTS5 (0.51) ADAMTS5ADAMTS4MMP13ESR1
SCHEMBL15904171 0.68 ADAMTS5 (0.67) ADAMTS5ADAMTS4MMP2MMP9MMP8

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
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