SCHEMBL7140679

SCHEMBL7140679

O=C(O)CCN(C1(C(=O)NO)CC2OC(CCc3ccccc3)OC2C1)S(=O)(=O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 8/20 0.55
MMP2 P08253 6/20 0.42
MMP13 P45452 6/20 0.42
MMP9 P14780 5/20 0.42
MMP3 P08254 4/20 0.42
MMP8 P22894 5/20 0.41
MMP14 P50281 4/20 0.41
MMP16 P51512 3/20 0.41
BMP1 P13497 6/20 0.41
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
FFAR1 O14842 1/20 0.39
PTGES O14684 1/20 0.39
ADAM17 P78536 1/20 0.37
DAGLA Q9Y4D2 1/20 0.37

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
SCHEMBL6996412 0.83 MMP1 (0.61) MMP1MMP2MMP13MMP9MMP3
SCHEMBL6996411 0.83 MMP1 (0.61) MMP1MMP2MMP13MMP9MMP3
SCHEMBL6876444 0.79 MMP1 (0.81) MMP1MMP2MMP13MMP9MMP3
SCHEMBL6699509 0.79 MMP1 (0.84) MMP1MMP2MMP13MMP9MMP3
SCHEMBL6873149 0.78 MMP1 (0.70) MMP1MMP2MMP13MMP9MMP3
SCHEMBL7330071 0.78 MMP1 (0.59) MMP1MMP2MMP13MMP9MMP3
SCHEMBL7143794 0.78 MMP1 (0.73) MMP1MMP2MMP13MMP9MMP3
SCHEMBL7003643 0.76 MMP1 (0.73) MMP1MMP2MMP13MMP9MMP3
SCHEMBL7000070 0.76 MMP1 (0.59) MMP1MMP2MMP13MMP9MMP3
SCHEMBL6862104 0.76 MMP1 (0.73) MMP1MMP2MMP13MMP9MMP3

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