SCHEMBL7698774

SCHEMBL7698774

COc1ccc(S(=O)(=O)C2CCN(C(C)C)C(C(=O)NO)C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 18/20 0.54
ADAM17 P78536 1/20 0.54
MMP9 P14780 11/20 0.53
MMP2 P08253 6/20 0.53
MMP3 P08254 17/20 0.53
MMP7 P09237 15/20 0.53
MMP13 P45452 14/20 0.53
MMP8 P22894 3/20 0.52

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
SCHEMBL7508761 0.88 MMP13 (0.50) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7510882 0.85 MMP1 (0.57) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7442655 0.85 MMP1 (0.57) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7503957 0.83 MMP9 (0.53) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7529490 0.80 MMP13 (0.55) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7505164 0.79 MMP1 (0.58) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7618861 0.76 MMP1 (0.54) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7509176 0.76 MMP1 (0.51) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7510461 0.75 MMP13 (0.53) MMP1ADAM17MMP9MMP2MMP3
SCHEMBL7505801 0.72 MMP13 (0.50) MMP1ADAM17MMP9MMP2MMP3

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
US-6342508-B1 ENZYME INHIBITORS FOR PROTECTION OF CONNECTIVE TISSUES AMERICAN CYANAMID COMPANY 2002-01-29 US disclosed