SCHEMBL8448862

SCHEMBL8448862

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

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.57
▸ ADAMTS4 O75173 2/20 0.53
▸ MMP9 P14780 5/20 0.51
▸ MMP2 P08253 3/20 0.51
▸ MMP1 P03956 2/20 0.51
▸ MMP3 P08254 2/20 0.51
▸ MMP7 P09237 2/20 0.51
▸ MMP13 P45452 2/20 0.51
▸ HSD17B10 Q99714 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ HTT P42858 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ SLC1A3 P43003 1/20 0.48
▸ SLC1A2 P43004 1/20 0.48
▸ SLC1A1 P43005 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ ALDH1A1 P00352 4/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ CA2 P00918 2/20 0.47

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
SCHEMBL4975578 0.85 ADAMTS4 (0.71) TDP1ADAMTS4MMP9MMP2MMP1
SCHEMBL698908 0.85 ADAMTS4 (0.71) TDP1ADAMTS4MMP9MMP2MMP1
SCHEMBL698907 0.85 ADAMTS4 (0.71) TDP1ADAMTS4MMP9MMP2MMP1
Water SCHEMBL29881522 0.83 ADAMTS4 (0.69) TDP1ADAMTS4MMP9MMP2MMP1
SCHEMBL8448682 0.80 TDP1 (0.57) TDP1ADAMTS4MMP9MMP2MMP1
SCHEMBL8448545 0.77 ADAMTS4 (0.60) TDP1ADAMTS4MMP9MMP2MMP1
SCHEMBL8449004 0.77 MMP9 (0.75) ADAMTS4MMP9MMP2MMP1MMP3
SCHEMBL8448539 0.77 ADAMTS4 (0.60) TDP1ADAMTS4MMP9MMP2MMP1
SCHEMBL6793899 0.77 ADAMTS4 (0.60) TDP1ADAMTS4MMP9MMP2MMP1
SCHEMBL8450205 0.77 MMP9 (0.75) ADAMTS4MMP9MMP2MMP1MMP3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

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