SCHEMBL6967896

SCHEMBL6967896

O=C(NO)OC1(NS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)CCC1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 20/20 0.57
MMP13 P45452 17/20 0.57
MMP9 P14780 5/20 0.48
ADAM17 P78536 4/20 0.48
MMP2 P08253 2/20 0.48
MMP3 P08254 2/20 0.48
MMP7 P09237 2/20 0.48
MMP8 P22894 2/20 0.48
MMP14 P50281 2/20 0.48
ABCB11 O95342 1/20 0.46
MMP10 P09238 1/20 0.46

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
SCHEMBL6960996 0.95 MMP1 (0.60) MMP1MMP13MMP9ADAM17MMP2
SCHEMBL6947434 0.90 MMP1 (0.69) MMP1MMP13MMP9ADAM17MMP2
SCHEMBL7208085 0.88 MMP1 (0.68) MMP1MMP13MMP9ADAM17MMP2
SCHEMBL6957161 0.88 MMP1 (0.67) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6965530 0.86 MMP1 (0.67) MMP1MMP13MMP9MMP2MMP3
SCHEMBL7214305 0.85 MMP1 (0.67) MMP1MMP13MMP9ADAM17MMP2
SCHEMBL6968323 0.85 MMP1 (0.68) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6967193 0.83 MMP1 (0.66) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6957079 0.81 MMP1 (0.80) MMP1MMP13MMP9MMP2MMP3
SCHEMBL6954028 0.79 MMP1 (0.69) MMP1MMP13MMP9MMP2MMP3

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
EP-0977733-B1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER PROD INC (US) 2003-09-03 EP claimed