SCHEMBL6961969

SCHEMBL6961969

O=C(NO)OC1(NS(=O)(=O)c2ccc(-c3ccc(F)cc3)cc2)CCCC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 16/20 0.54
MMP13 P45452 16/20 0.54
MEP1B Q16820 1/20 0.47
MMP2 P08253 4/20 0.46
MMP9 P14780 4/20 0.46
MMP8 P22894 3/20 0.46
MMP3 P08254 3/20 0.46
MMP12 P39900 1/20 0.46
MMP14 P50281 1/20 0.46
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MMP7 P09237 1/20 0.40

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
SCHEMBL6960862 0.97 MMP1 (0.54) MMP1MMP13MEP1BMMP2MMP9
SCHEMBL6968116 0.95 MMP1 (0.56) MMP1MMP13MEP1BMMP2MMP9
SCHEMBL6965530 0.90 MMP1 (0.67) MMP1MMP13MMP2MMP9MMP8
SCHEMBL6968323 0.89 MMP1 (0.68) MMP1MMP13MMP2MMP9MMP8
SCHEMBL6950277 0.89 MMP1 (0.66) MMP1MMP13MEP1BMMP2MMP9
SCHEMBL6957161 0.88 MMP1 (0.67) MMP1MMP13MMP2MMP9MMP8
SCHEMBL6967193 0.85 MMP1 (0.66) MMP1MMP13MMP2MMP9MMP8
SCHEMBL6967655 0.80 MMP13 (0.60) MMP1MMP13MMP2MMP9MMP8
SCHEMBL7214282 0.79 MMP1 (0.68) MMP1MMP13MMP2MMP9MMP8
SCHEMBL6964498 0.78 MMP1 (0.79) MMP1MMP13MEP1BMMP2MMP9

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