SCHEMBL7163700

SCHEMBL7163700

CC1(C)C(C(=O)NO)N(S(=O)(=O)c2ccc3c4c(oc3c2)CCC4)CCS1(=O)=O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 19/20 0.58
▸ MMP3 P08254 14/20 0.58
▸ MMP13 P45452 13/20 0.58
▸ MMP2 P08253 13/20 0.58
▸ MMP7 P09237 11/20 0.57
▸ MMP9 P14780 6/20 0.54
▸ MMP8 P22894 6/20 0.54
▸ HTR6 P50406 1/20 0.38
▸ ADAM17 P78536 1/20 0.38

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
SCHEMBL7166258 0.98 MMP1 (0.58) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7163665 0.97 MMP1 (0.58) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7163437 0.97 MMP1 (0.58) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7162262 0.88 MMP1 (0.44) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7159157 0.83 MMP1 (0.58) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7161303 0.83 MMP1 (0.43) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7161963 0.81 MMP1 (0.57) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7164719 0.81 MMP1 (0.57) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7219783 0.79 MMP3 (0.61) MMP1MMP3MMP13MMP2MMP7
SCHEMBL7162466 0.79 HTR6 (0.40) MMP1MMP3MMP13MMP2MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6555535-B2 Anticancer, antiarthritic, and antiinflammatory agents, and heart failure treatment WARNER-LAMBERT COMPANY 2003-04-29 — — US claimed
EP-1233018-A2 Tricyclic biphenyl sulfonamide matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2002-08-21 — — EP claimed
US-6555535-B2 Anticancer, antiarthritic, and antiinflammatory agents, and heart failure treatment WARNER-LAMBERT COMPANY 2003-04-29 — — US disclosed
EP-1233018-A2 Tricyclic biphenyl sulfonamide matrix metalloproteinase inhibitors WARNER-LAMBERT COMPANY (US) 2002-08-21 — — EP disclosed
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