SCHEMBL6590108

SCHEMBL6590108

COCC[C@@H](C(=O)OC)S(=O)(=O)N1CC=C(c2ccc(-c3ccccc3)c(C)c2)CC1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.61
MMP3 P08254 12/20 0.61
L3MBTL1 Q9Y468 1/20 0.43
NAMPT P43490 1/20 0.40
USP5 P45974 1/20 0.40
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL6590105 1.00 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6590102 1.00 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6588092 0.93 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6588095 0.93 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6588097 0.93 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6587795 0.91 MMP2 (0.65) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6587788 0.91 MMP2 (0.65) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6587784 0.91 MMP2 (0.65) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6588492 0.87 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTUSP5
SCHEMBL6588498 0.87 MMP2 (0.61) MMP2MMP3L3MBTL1NAMPTUSP5

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