SCHEMBL7137882

SCHEMBL7137882

O=C(NO)C1(CS(=O)(=O)c2ccc(Oc3ccc(F)cc3)cc2)CC2OCOC2C1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 17/20 0.54
MMP1 P03956 16/20 0.54
MMP2 P08253 9/20 0.54
MMP9 P14780 5/20 0.54
MMP3 P08254 4/20 0.54
MMP14 P50281 4/20 0.54
ADAM17 P78536 4/20 0.54
MMP8 P22894 3/20 0.54
ABCB11 O95342 1/20 0.54
MMP7 P09237 1/20 0.54
MMP10 P09238 1/20 0.54
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
SCHEMBL7143052 0.90 MMP13 (0.45) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7139159 0.90 MMP1 (0.52) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7136827 0.89 MMP1 (0.69) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7137915 0.89 MMP2 (0.44) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7144625 0.88 MMP13 (0.53) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7139217 0.88 MMP13 (0.53) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7000007 0.85 MMP13 (0.66) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7140185 0.85 MMP1 (0.40) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7137874 0.85 MMP1 (0.46) MMP13MMP1MMP2MMP9MMP3
SCHEMBL7142568 0.84 MMP13 (0.52) MMP13MMP1MMP2MMP9MMP3

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-1041072-B1 Dioxocyclopentyl hydroxamic acids PFIZER PROD INC (US) 2003-07-16 EP disclosed
US-6214870-B1 ANTIARTHRITIC AGENTS; ANTICANCER AGENTS PFIZER INC 2001-04-10 US disclosed
EP-1041072-A1 Dioxocyclopentyl hydroxamic acids Pfizer Products Inc. (US) 2000-10-04 EP disclosed