SCHEMBL6584490

SCHEMBL6584490

Cc1cc(C2CCN(S(=O)(=O)C(C)(C)C(=O)NO)CC2)ccc1-c1cccc(C#N)c1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 8/20 0.71
MMP2 P08253 7/20 0.71
MMP1 P03956 2/20 0.70
MMP9 P14780 2/20 0.70
MMP14 P50281 2/20 0.70
PAX8 Q06710 1/20 0.39
TLR9 Q9NR96 1/20 0.38
BCL9 O00512 1/20 0.37
CTNNB1 P35222 1/20 0.37
HCRTR2 O43614 1/20 0.37
LRRK2 Q5S007 2/20 0.36
CHRM3 P20309 1/20 0.36
MCHR1 Q99705 1/20 0.36
HSD11B1 P28845 1/20 0.35

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
SCHEMBL7404142 0.99 MMP3 (0.70) MMP3MMP2MMP1MMP9MMP14
SCHEMBL7404145 0.91 MMP2 (0.59) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6585076 0.83 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6585851 0.82 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
Dimethylamine SCHEMBL6974207 0.81 MMP3 (0.97) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6586804 0.81 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6973528 0.81 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
Hydrochloric Acid SCHEMBL6971643 0.80 MMP3 (0.98) MMP3MMP2MMP1MMP9MMP14
SCHEMBL6972635 0.80 MMP3 (1.00) MMP3MMP2MMP1MMP9MMP14
Hydrochloric Acid SCHEMBL6962275 0.80 MMP3 (0.98) 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