SCHEMBL6586496

SCHEMBL6586496

COC(=O)CS(=O)(=O)N1CC=C(c2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.69
MMP3 P08254 11/20 0.69
ALDH1A1 P00352 1/20 0.55
PKM P14618 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.51
USP5 P45974 1/20 0.51
KDM4E B2RXH2 1/20 0.49
HSD11B1 P28845 2/20 0.47

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
SCHEMBL6590060 0.97 MMP3 (0.73) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6586576 0.88 MMP2 (0.80) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6585783 0.87 MMP2 (0.59) MMP2MMP3ALDH1A1PKMUSP5
SCHEMBL6587364 0.87 MMP2 (0.63) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6586123 0.87 MMP2 (0.78) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6583675 0.85 MMP2 (0.79) MMP2MMP3ALDH1A1PKML3MBTL1
SCHEMBL6586571 0.84 MMP3 (0.95) MMP2MMP3ALDH1A1PKMUSP5
SCHEMBL6584687 0.83 MMP2 (0.67) MMP2MMP3
SCHEMBL6587433 0.82 MMP3 (1.00) MMP2MMP3ALDH1A1PKMUSP5
SCHEMBL6440525 0.81 MMP2 (0.59) MMP2MMP3L3MBTL1KDM4E

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 4 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
EP-1036062-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS Pfizer Limited (GB) 2000-09-20 EP disclosed
WO-1999029667-A1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LIMITED (GB) 1999-06-17 WO disclosed