SCHEMBL6587889

SCHEMBL6587889

CCOc1cccc(-c2ccc(C3CCN(S(=O)(=O)C4(C(=O)NO)CCOCC4)CC3)cc2C)c1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 18/20 0.65
MMP3 P08254 9/20 0.65
MMP9 P14780 7/20 0.56
MMP14 P50281 3/20 0.56
MMP1 P03956 3/20 0.56
MMP13 P45452 10/20 0.45
ADAM17 P78536 1/20 0.39

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
SCHEMBL7415783 0.99 MMP2 (0.65) MMP2MMP3MMP9MMP14MMP1
SCHEMBL7415782 0.92 MMP2 (0.59) MMP2MMP3MMP9MMP14MMP1
SCHEMBL6968408 0.92 MMP2 (0.67) MMP2MMP3MMP9MMP14MMP1
SCHEMBL6585463 0.91 MMP2 (0.53) MMP2MMP3MMP9MMP14MMP1
Hydrochloric Acid SCHEMBL6972714 0.91 MMP2 (0.66) MMP2MMP3MMP9MMP14MMP1
SCHEMBL6966219 0.90 MMP2 (0.54) MMP2MMP3MMP9MMP14MMP1
SCHEMBL6966390 0.90 MMP2 (0.54) MMP2MMP3MMP9MMP14MMP1
SCHEMBL6971565 0.87 MMP2 (0.58) MMP2MMP3MMP9MMP14MMP1
SCHEMBL6586370 0.85 MMP2 (0.56) MMP2MMP3MMP9MMP14MMP1
SCHEMBL6584479 0.85 MMP2 (0.56) MMP2MMP3MMP9MMP14MMP1

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