SCHEMBL7004527

SCHEMBL7004527

CCN(c1c(OC(=O)NO)cnc2ccc(C#Cc3ccccc3)cc12)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 14/20 0.51
MMP13 P45452 14/20 0.51
MMP9 P14780 12/20 0.51
ADAM17 P78536 7/20 0.42
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
KEAP1 Q14145 4/20 0.40
NFE2L2 Q16236 4/20 0.40
BMP1 P13497 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
SCHEMBL7012429 0.87 MMP1 (0.68) MMP1MMP13MMP9ADAM17
SCHEMBL7423599 0.85 MMP1 (0.55) MMP1MMP13MMP9ADAM17TP53
SCHEMBL6289470 0.82 MMP1 (0.53) MMP1MMP13MMP9ADAM17TP53
SCHEMBL7009850 0.81 MMP9 (0.76) MMP1MMP13MMP9ADAM17
SCHEMBL7008346 0.78 MMP13 (0.78) MMP1MMP13MMP9ADAM17
SCHEMBL7007184 0.78 MMP1 (0.62) MMP1MMP13MMP9ADAM17
SCHEMBL7005027 0.76 MMP1 (0.76) MMP1MMP13MMP9ADAM17
SCHEMBL7013036 0.76 MMP1 (0.64) MMP1MMP13MMP9ADAM17KEAP1
SCHEMBL7006362 0.76 MMP1 (0.53) MMP1MMP13MMP9ADAM17KEAP1
SCHEMBL6293228 0.75 MMP1 (0.49) MMP1MMP13MMP9ADAM17TP53

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-1021413-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO BICYCLIC HETEROARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS WYETH CORP (US) 2003-06-11 EP claimed