SCHEMBL8400808

SCHEMBL8400808

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

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BMP1 P13497 7/20 0.44
MMP1 P03956 5/20 0.44
MMP9 P14780 4/20 0.44
MMP13 P45452 4/20 0.44
MMP2 P08253 4/20 0.42
MMP7 P09237 1/20 0.42
MMP12 P39900 1/20 0.42
MMP3 P08254 3/20 0.41
CXCR3 P49682 1/20 0.41
MMP8 P22894 3/20 0.40
STS P08842 1/20 0.40
TGFBR1 P36897 1/20 0.39
MEP1B Q16820 1/20 0.39

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
SCHEMBL8404845 0.88 MMP3 (0.44) BMP1MMP1MMP9MMP13MMP2
SCHEMBL8404582 0.87 MMP9 (0.41) BMP1MMP1MMP9MMP13MMP2
SCHEMBL8658468 0.84 BMP1 (0.48) BMP1MMP1MMP9MMP13MMP2
SCHEMBL8004745 0.84 MMP9 (0.51) BMP1MMP1MMP9MMP13MMP2
SCHEMBL8400820 0.84 ALDH1A1 (0.49) BMP1MMP1MMP8
SCHEMBL8014648 0.84 MMP9 (0.51) BMP1MMP1MMP9MMP13MMP2
SCHEMBL8403382 0.83 MMP9 (0.45) BMP1MMP1MMP9MMP13MMP2
SCHEMBL8012934 0.83 BMP1 (0.51) BMP1MMP1MMP9MMP13MMP2
SCHEMBL8015780 0.83 MMP9 (0.51) BMP1MMP1MMP9MMP13MMP2
SCHEMBL8004734 0.83 BMP1 (0.55) BMP1MMP1MMP9MMP13MMP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0922030-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1999-06-16 EP disclosed
WO-1998007697-A1 ARYLSULFONYLAMINO HYDROXAMIC ACID DERIVATIVES PFIZER INC. (US) 1998-02-26 WO disclosed