SCHEMBL6585852

SCHEMBL6585852

COC(=O)C(C)(C)S(=O)(=O)N1CCC(c2ccc(-c3cccc(OCCO[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)c3)c(C)c2)CC1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 11/20 0.67
MMP2 P08253 10/20 0.67
MMP1 P03956 2/20 0.65
MMP9 P14780 2/20 0.65
MMP14 P50281 2/20 0.65
GNRHR P30968 1/20 0.34
USP5 P45974 1/20 0.34
HTR7 P34969 1/20 0.34
DHODH Q02127 2/20 0.33
BCL9 O00512 1/20 0.33
CTNNB1 P35222 1/20 0.33
MCHR1 Q99705 1/20 0.33

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
SCHEMBL6590355 0.94 MMP2 (0.66) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6586333 0.88 MMP2 (0.85) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6434351 0.86 MMP2 (0.84) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6437562 0.85 MMP2 (0.84) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6587846 0.85 MMP2 (0.83) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6587437 0.84 MMP2 (0.83) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6586866 0.83 MMP2 (0.54) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6436990 0.83 MMP3 (0.69) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6971949 0.82 MMP2 (0.68) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6971954 0.82 MMP2 (0.68) MMP3MMP2MMP1MMP9MMP14

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