SCHEMBL7305528

SCHEMBL7305528

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 15/20 1.00
MMP2 P08253 9/20 1.00
MMP1 P03956 11/20 0.52
MMP3 P08254 8/20 0.52
MMP7 P09237 6/20 0.52
MMP13 P45452 5/20 0.52
SMN1; SMN2 Q16637 1/20 0.49
MMP8 P22894 2/20 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
SCHEMBL7305533 1.00 MMP9 (1.00) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7308413 0.97 MMP9 (0.95) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7308416 0.97 MMP9 (0.95) MMP9MMP2MMP1MMP3MMP7
SCHEMBL31630322 0.86 MMP9 (0.76) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7302689 0.85 MMP9 (0.74) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7302697 0.85 MMP9 (0.74) MMP9MMP2MMP1MMP3MMP7
SCHEMBL31630255 0.85 MMP2 (0.74) MMP9MMP2MMP1MMP3MMP7
SCHEMBL31630491 0.85 MMP2 (0.74) MMP9MMP2MMP1MMP3MMP7
SCHEMBL8524352 0.85 MMP9 (0.72) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7305247 0.83 MMP9 (0.70) 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