SCHEMBL8003322

SCHEMBL8003322

COc1ccc(S(=O)(=O)N(CCC(=O)N2CCC(N(C)C(=O)OC(C)(C)C)CC2)C(C(=O)NO)C(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 14/20 0.51
MMP13 P45452 12/20 0.51
MMP9 P14780 12/20 0.51
MMP8 P22894 12/20 0.51
BMP1 P13497 4/20 0.44
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
MMP1 P03956 1/20 0.43

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
SCHEMBL8017911 0.90 BMP1 (0.46) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8004739 0.89 BMP1 (0.47) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8014645 0.89 BMP1 (0.47) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8015392 0.89 MMP2 (0.57) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8012932 0.87 BMP1 (0.48) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8013050 0.87 MMP1 (0.50) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8004730 0.87 BMP1 (0.53) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8012218 0.86 BMP1 (0.55) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8012992 0.85 BMP1 (0.47) MMP2MMP13MMP9MMP8BMP1
SCHEMBL8012982 0.85 MMP2 (0.61) MMP2MMP13MMP9MMP8BMP1

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
US-6153609-A Arylsulfonylamino hydroxamic acid derivatives PFIZER INC (US) 2000-11-28 US disclosed