Sugi Predict

Sugi Predict / Compounds / SCHEMBL5787705

SCHEMBL5787705

SCHEMBL5787705

CCC(C)C(NS(=O)(=O)c1ccc(-c2ccc(NC(=O)c3cc4ccccc4o3)cc2)cc1)C(=O)O

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 16/20 0.83
▸ MMP13 P45452 5/20 0.83
▸ MMP14 P50281 3/20 0.83
▸ ADAMTS4 O75173 3/20 0.83
▸ MMP7 P09237 1/20 0.83
▸ MMP12 P39900 1/20 0.83

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
SCHEMBL3618625 1.00 MMP2 (0.83) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL3612423 1.00 MMP2 (0.83) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL3618623 1.00 MMP2 (0.83) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL3612421 1.00 MMP2 (0.83) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL2382350 0.91 MMP2 (1.00) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL3616920 0.91 MMP2 (1.00) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL3618624 0.91 MMP2 (1.00) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL3613277 0.88 MMP2 (0.84) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL3613278 0.88 MMP2 (0.84) MMP2MMP13MMP14ADAMTS4MMP7
SCHEMBL3618034 0.87 MMP2 (0.82) MMP2MMP13MMP14ADAMTS4MMP7

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-1692124-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS Wyeth (US) 2006-08-23 — — EP disclosed
WO-2005061477-A1 BIARYL SULFONAMIDES AS MMP INHIBITORS WYETH (US) 2005-07-07 — — WO disclosed