SCHEMBL7472837

SCHEMBL7472837

COc1ccc(S(=O)(=O)N(C)c2c(C(=O)ON)cnc3ccc(CCc4ccccc4)cc23)cc1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 9/20 0.53
MMP13 P45452 9/20 0.53
MMP9 P14780 8/20 0.53
ADAM17 P78536 5/20 0.46
KEAP1 Q14145 3/20 0.45
LMNA P02545 3/20 0.45
NFE2L2 Q16236 2/20 0.45
MAPT P10636 2/20 0.45
TP53 P04637 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
THRB P10828 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42

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
Hydroxyamine SCHEMBL7472830 0.91 MMP1 (0.54) MMP1MMP13MMP9ADAM17KEAP1
SCHEMBL7355097 0.91 MMP1 (0.56) MMP1MMP13MMP9ADAM17KEAP1
SCHEMBL7010431 0.88 MMP1 (0.68) MMP1MMP13MMP9ADAM17
SCHEMBL7006362 0.81 MMP1 (0.53) MMP1MMP13MMP9ADAM17KEAP1
SCHEMBL7418158 0.78 MMP13 (0.80) MMP1MMP13MMP9ADAM17
SCHEMBL6289453 0.76 MAPT (0.51) MMP1MMP13MMP9ADAM17KEAP1
SCHEMBL7420153 0.75 MMP1 (0.77) MMP1MMP13MMP9ADAM17KEAP1
SCHEMBL6293228 0.75 MMP1 (0.49) MMP1MMP13MMP9ADAM17KEAP1
Hydroxyamine SCHEMBL7472827 0.75 MMP1 (0.47) MMP1MMP13MMP9ADAM17KEAP1
SCHEMBL7010429 0.72 MMP1 (0.60) MMP1MMP13MMP9ADAM17

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
WO-1998016514-A1 ORTHO-SULFONAMIDO BICYCLIC HETEROARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-04-23 WO disclosed