SCHEMBL6587473

SCHEMBL6587473

CC(C)(C(=O)O)S(=O)(=O)N1CC=C(c2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 6/20 0.58
MMP3 P08254 6/20 0.58
ALDH1A1 P00352 1/20 0.55
PKM P14618 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.51
KDM4E B2RXH2 1/20 0.49
HSD11B1 P28845 5/20 0.47
KMT2A Q03164 1/20 0.46
USP5 P45974 1/20 0.46

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
SCHEMBL6590225 0.88 MMP2 (0.63) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6584985 0.85 MMP2 (0.51) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6590247 0.84 MMP2 (0.58) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6585837 0.82 MMP2 (0.50) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6584729 0.77 MMP2 (0.63) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6585805 0.77 MMP2 (0.57) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6586466 0.77 MMP2 (0.51) MMP2MMP3L3MBTL1HSD11B1
SCHEMBL6584020 0.77 MMP2 (0.72) MMP2MMP3
SCHEMBL6587154 0.77 MMP2 (0.52) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6586274 0.75 MMP2 (0.55) MMP2MMP3KDM4E

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-1036062-B1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LTD (GB) 2004-01-02 EP disclosed
US-6495568-B1 TREATMENT OF TISSUE ULCERATION, WOUND REPAIR AND SKIN DISEASES WARNER-LAMBERT COMPANY 2002-12-17 US disclosed