SCHEMBL6587364

SCHEMBL6587364

COC(=O)CS(=O)(=O)N1CC=C(c2ccc(-c3ccccc3)c(OC)c2)CC1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.63
MMP3 P08254 12/20 0.63
QDPR P09417 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CCNT1 O60563 1/20 0.43
CDK9 P50750 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
HSD11B1 P28845 1/20 0.43

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
SCHEMBL6586371 0.91 MMP3 (0.77) MMP2MMP3QDPRL3MBTL1KDM4E
SCHEMBL6586129 0.91 MMP2 (0.70) MMP2MMP3QDPRCCNT1CDK9
SCHEMBL6586576 0.89 MMP2 (0.80) MMP2MMP3L3MBTL1KDM4EALDH1A1
SCHEMBL6586123 0.88 MMP2 (0.78) MMP2MMP3L3MBTL1CCNT1CDK9
SCHEMBL6590304 0.87 MMP2 (0.69) MMP2MMP3QDPRCCNT1CDK9
SCHEMBL6590060 0.87 MMP3 (0.73) MMP2MMP3L3MBTL1KDM4EALDH1A1
SCHEMBL6586496 0.87 MMP2 (0.69) MMP2MMP3L3MBTL1KDM4EALDH1A1
SCHEMBL6583675 0.85 MMP2 (0.79) MMP2MMP3L3MBTL1CCNT1CDK9
SCHEMBL6590619 0.84 MMP2 (0.65) MMP2MMP3QDPRCCNT1CDK9
SCHEMBL6587154 0.82 MMP2 (0.52) MMP2MMP3QDPRL3MBTL1KDM4E

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