SCHEMBL8404845

SCHEMBL8404845

COc1ccc(S(=O)(=O)N(CCC(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)CC(C(=O)NO)C2CCCCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 6/20 0.44
MMP2 P08253 8/20 0.44
MMP9 P14780 7/20 0.44
MMP1 P03956 7/20 0.44
MMP13 P45452 6/20 0.44
MMP8 P22894 3/20 0.44
MMP7 P09237 1/20 0.42
MMP12 P39900 1/20 0.42
BMP1 P13497 3/20 0.41
TGFBR1 P36897 1/20 0.38

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
SCHEMBL8400808 0.88 BMP1 (0.44) MMP3MMP2MMP9MMP1MMP13
SCHEMBL8404582 0.85 MMP9 (0.41) MMP3MMP2MMP9MMP1MMP13
SCHEMBL8012967 0.84 MMP9 (0.51) MMP3MMP2MMP9MMP1MMP13
SCHEMBL8658468 0.82 BMP1 (0.48) MMP3MMP2MMP9MMP1MMP13
SCHEMBL8014840 0.82 MMP3 (0.46) MMP3MMP2MMP9MMP1MMP13
SCHEMBL8004745 0.82 MMP9 (0.51) MMP3MMP2MMP9MMP1MMP13
SCHEMBL8014648 0.82 MMP9 (0.51) MMP3MMP2MMP9MMP1MMP13
SCHEMBL8405651 0.82 ALDH1A1 (0.49) MMP3MMP2MMP1MMP13MMP8
SCHEMBL8403382 0.81 MMP9 (0.45) MMP3MMP2MMP9MMP1MMP13
SCHEMBL8012934 0.81 BMP1 (0.51) MMP3MMP2MMP9MMP1MMP13

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