SCHEMBL7360464

SCHEMBL7360464

CNC(=O)[C@H](Cc1ccccc1)NC(=O)N(O)C(=O)CCCCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 9/20 0.53
MMP3 P08254 7/20 0.53
MMP9 P14780 1/20 0.53
MMP2 P08253 10/20 0.53
MMP7 P09237 1/20 0.53
ALOX5 P09917 2/20 0.51
CTSG P08311 1/20 0.48
CMA1 P23946 1/20 0.48
FCER2 P06734 1/20 0.47
KDM4A O75164 1/20 0.47
KDM5A P29375 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
PHF8 Q9UPP1 1/20 0.47
KDM2A Q9Y2K7 1/20 0.47
MMP8 P22894 2/20 0.47

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
SCHEMBL7360065 0.87 MMP1 (0.51) MMP1MMP3MMP9MMP2MMP7
SCHEMBL7363512 0.79 MMP3 (0.45) MMP1MMP3MMP2MMP8
SCHEMBL7357715 0.77 NPC1 (0.49) MMP1MMP9MMP8
SCHEMBL7363203 0.76 MMP1 (0.40) MMP1MMP3MMP9MMP2MMP7
SCHEMBL27538399 0.76 MMP1 (0.52) MMP1MMP3MMP9MMP2MMP7
SCHEMBL6898025 0.76 MMP1 (0.52) MMP1MMP3MMP9MMP2MMP7
SCHEMBL8749847 0.76 NAALAD2 (0.52) MMP9MMP2MMP7
SCHEMBL7354243 0.76 NAALAD2 (0.52) MMP9MMP2MMP7
SCHEMBL7357691 0.76 CTSL (0.45) MMP1MMP3MMP2MMP8
SCHEMBL7357664 0.75 ALDH1A1 (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691382-A ENZYME INHIBITORS FOR CARDIOVASCULAR DISORDERS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-11-25 US disclosed
EP-0667770-B1 INHIBITION OF TNF PRODUCTION BRITISH BIOTECH PHARM (GB) 1997-03-19 EP disclosed
EP-0667770-A1 INHIBITION OF TNF PRODUCTION. BRITISH BIOTECH PHARM (GB) 1995-08-23 EP disclosed
WO-1994010990-A1 INHIBITION OF TNF PRODUCTION BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1994-05-26 WO disclosed