SCHEMBL4671377

SCHEMBL4671377

CN(C)C(=O)N1CCN(S(=O)(=O)N2CCc3c([nH]c4cc(F)ccc34)C2)[C@@H](C(=O)NO)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 4/20 0.47
MMP14 P50281 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.47
MMP3 P08254 4/20 0.38
MMP13 P45452 3/20 0.38
MMP7 P09237 2/20 0.38
MMP9 P14780 2/20 0.38
TRPV1 Q8NER1 2/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
CDK4 P11802 4/20 0.36

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
SCHEMBL7447815 0.74 LMNA (0.43) MMP1MMP3MMP13MMP7MMP9
SCHEMBL4671560 0.74 LMNA (0.43) MMP1MMP3MMP13MMP7MMP9
SCHEMBL4671384 0.74 HSD11B1 (0.47)
SCHEMBL4674873 0.74 MMP1 (0.40) MMP1MMP3MMP13MMP7MMP9
SCHEMBL4674806 0.73 MMP13 (0.38) MMP1MMP3MMP13MMP7MMP9
SCHEMBL7453945 0.73 MMP13 (0.38) MMP1MMP3MMP13MMP7MMP9
SCHEMBL4673266 0.73 USP5 (0.41) MMP1MMP3MMP13MMP7MMP9
SCHEMBL4676394 0.71 HDAC6 (0.52) MMP1MMP3TRPV1HDAC1HDAC6
SCHEMBL4670994 0.70 MMP1 (0.39) MMP1MMP3MMP13MMP7MMP9
SCHEMBL7504893 0.70 MMP1 (0.39) MMP1MMP3MMP13MMP7MMP9

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0958287-B2 SULFAMIDE-METALLOPROTEASE INHIBITORS HOFFMANN LA ROCHE (CH) 2008-04-09 EP disclosed
EP-0958287-B1 SULFAMIDE-METALLOPROTEASE INHIBITORS HOFFMANN LA ROCHE (CH) 2002-09-11 EP disclosed
US-6143744-A Sulfamide-metalloprotease inhibitors SYNTEX (U.S.A.) INC. (US) 2000-11-07 US disclosed
US-6130220-A ENZYME INHIBITORS SYNTEX (USA) INC. (US) 2000-10-10 US disclosed
US-5998412-A ANTIARTHRITIC AGENTS; OSTEOPOROSIS SYNTEX (U.S.A.) INC. (US) 1999-12-07 US disclosed