SCHEMBL6584515

SCHEMBL6584515

CCOc1cccc(-c2ccc(C3=CCN(S(=O)(=O)C(C)(C)C(=O)OC)CC3)cc2OC)c1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 17/20 0.59
MMP3 P08254 17/20 0.59
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
MMP14 P50281 1/20 0.41
QDPR P09417 1/20 0.39
CCNT1 O60563 2/20 0.38
CDK9 P50750 2/20 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
SCHEMBL6586229 0.92 MMP2 (0.59) MMP2MMP3MMP9QDPRCCNT1
SCHEMBL6582915 0.91 MMP2 (0.72) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6587154 0.87 MMP2 (0.52) MMP2MMP3QDPR
SCHEMBL6590304 0.86 MMP2 (0.69) MMP2MMP3QDPRCCNT1CDK9
SCHEMBL6439725 0.83 MMP2 (0.62) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6590027 0.83 MMP2 (0.61) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6584020 0.82 MMP2 (0.72) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6586191 0.82 MMP2 (0.76) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6588374 0.81 MMP2 (0.70) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6588048 0.80 MMP2 (0.57) MMP2MMP3MMP1MMP9MMP14

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