SCHEMBL7308413

SCHEMBL7308413

COc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2C(=O)NO)cc1

nearest known ligand 0.95

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 15/20 0.95
MMP2 P08253 9/20 0.95
MMP1 P03956 12/20 0.55
MMP3 P08254 9/20 0.55
MMP7 P09237 6/20 0.55
MMP13 P45452 5/20 0.55
SMN1; SMN2 Q16637 1/20 0.52
ADAM17 P78536 1/20 0.47
MMP8 P22894 1/20 0.47
MMP12 P39900 1/20 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
SCHEMBL7308416 1.00 MMP9 (0.95) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7305533 0.97 MMP9 (1.00) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7305528 0.97 MMP9 (1.00) MMP9MMP2MMP1MMP3MMP7
SCHEMBL8524352 0.87 MMP9 (0.72) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7305247 0.85 MMP9 (0.70) MMP9MMP2MMP1MMP3MMP7
SCHEMBL8525263 0.85 MMP9 (0.70) MMP9MMP2MMP1MMP3MMP7
SCHEMBL27476403 0.85 MMP9 (0.70) MMP9MMP2MMP1MMP3MMP7
SCHEMBL27432261 0.85 MMP9 (0.70) MMP9MMP2MMP1MMP3MMP7
SCHEMBL31630322 0.84 MMP9 (0.76) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7302697 0.83 MMP9 (0.74) MMP9MMP2MMP1MMP3MMP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780386-B1 Matrix metalloprotease inhibitors HOFFMANN LA ROCHE (CH) 2002-10-02 EP disclosed
US-5932595-A ANTIARTHRITIC AGENT; MULTIPLE SCLEROSIS; OSTEOPOROSIS; RESPIRATORY SYSTEM DISORDERS; SKIN DISORDERS; ANTIULCER AGENT SYNTEX (U.S.A.) INC. (US) 1999-08-03 US disclosed
EP-0780386-A1 Matrix metalloprotease inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1997-06-25 EP disclosed