SCHEMBL7325752

SCHEMBL7325752

CCC#CCOc1ccc(S(=O)(=O)N2CCSC(C)(C)C2C(=O)NO)cc1

nearest known ligand 0.86

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 0.86
ADAM17 P78536 19/20 0.86
MMP13 P45452 19/20 0.86
MMP9 P14780 4/20 0.86
MMP3 P08254 3/20 0.86
ADAM10 O14672 2/20 0.86
ADAM9 Q13443 2/20 0.86
MMP2 P08253 2/20 0.84
MMP7 P09237 1/20 0.71
MMP8 P22894 1/20 0.71

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
SCHEMBL3941871 1.00 MMP1 (0.86) MMP1ADAM17MMP13MMP9MMP3
SCHEMBL7325140 0.93 MMP1 (0.86) MMP1ADAM17MMP13MMP9MMP3
Apratastat SCHEMBL2834310 0.93 MMP1 (1.00) MMP1ADAM17MMP13MMP9MMP3
Apratastat SCHEMBL3946334 0.93 MMP1 (1.00) MMP1ADAM17MMP13MMP9MMP3
Apratastat SCHEMBL7430863 0.92 MMP1 (0.98) MMP1ADAM17MMP13MMP9MMP3
SCHEMBL3948013 0.92 MMP1 (0.85) MMP1ADAM17MMP13MMP9MMP3
SCHEMBL6498529 0.92 MMP1 (1.00) MMP1ADAM17MMP13MMP9MMP3
SCHEMBL2358255 0.92 ADAM17 (1.00) MMP1ADAM17MMP13MMP9MMP3
SCHEMBL3942486 0.92 ADAM17 (1.00) MMP1ADAM17MMP13MMP9MMP3
SCHEMBL8051411 0.92 MMP1 (0.86) MMP1ADAM17MMP13MMP9MMP3

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-6387901-B1 ANTIINFLAMMATORY AGENTS; ANTICANCER AGENTS PFIZER INC 2002-05-14 US disclosed