SCHEMBL7143052

SCHEMBL7143052

O=C(NO)C1(CS(=O)(=O)c2ccc(-c3ccc(F)cc3)cc2)CC2OCOC2C1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 16/20 0.45
MMP1 P03956 10/20 0.45
MMP2 P08253 13/20 0.42
ADAM17 P78536 10/20 0.42
MMP14 P50281 6/20 0.42
MMP9 P14780 5/20 0.42
MMP3 P08254 4/20 0.42
MMP8 P22894 3/20 0.42
ABCB11 O95342 1/20 0.42
MMP7 P09237 1/20 0.42
MMP10 P09238 1/20 0.42
MEP1B Q16820 1/20 0.41
MMP12 P39900 1/20 0.36

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
SCHEMBL7137882 0.90 MMP13 (0.54) MMP13MMP1MMP2ADAM17MMP14
SCHEMBL7144631 0.88 MMP13 (0.44) MMP13MMP1MMP2ADAM17MMP14
SCHEMBL7139159 0.87 MMP1 (0.52) MMP13MMP1MMP2ADAM17MMP14
SCHEMBL7137915 0.86 MMP2 (0.44) MMP13MMP1MMP2ADAM17MMP14
SCHEMBL7137874 0.81 MMP1 (0.46) MMP13MMP1MMP2ADAM17MMP14
SCHEMBL7141581 0.81 MMP1 (0.59) MMP13MMP1MMP2ADAM17MMP14
SCHEMBL7134721 0.80 MMP1 (0.52) MMP13MMP1MMP2ADAM17
SCHEMBL7136827 0.79 MMP1 (0.69) MMP13MMP1MMP2ADAM17MMP14
SCHEMBL7144625 0.78 MMP13 (0.53) MMP13MMP1MMP2ADAM17MMP14
SCHEMBL7139217 0.78 MMP13 (0.53) MMP13MMP1MMP2ADAM17MMP14

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