SCHEMBL7354511

SCHEMBL7354511

CNC(=O)[C@H](Cc1ccc(OCC(N)=O)cc1)NC(=O)N(O)C(=O)CCCC(C)C

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 16/20 0.44
MMP9 P14780 4/20 0.41
MMP8 P22894 2/20 0.41
MMP3 P08254 6/20 0.41
MMP2 P08253 3/20 0.41
ADAM17 P78536 1/20 0.40
MMP7 P09237 1/20 0.39
MMP13 P45452 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
SCHEMBL7356588 0.91 MMP1 (0.41) MMP1MMP9MMP8MMP3MMP2
SCHEMBL7364166 0.90 MMP9 (0.41) MMP1MMP9MMP8MMP3MMP2
SCHEMBL7356834 0.89 MMP1 (0.41) MMP1MMP9MMP8MMP3MMP2
SCHEMBL6416552 0.87 MMP1 (0.54) MMP1MMP9MMP8MMP3MMP2
SCHEMBL7363203 0.85 MMP1 (0.40) MMP1MMP9MMP8MMP3MMP2
SCHEMBL7360065 0.83 MMP1 (0.51) MMP1MMP9MMP8MMP3MMP2
SCHEMBL7360049 0.82 MMP1 (0.38) MMP1MMP9MMP8MMP3MMP2
SCHEMBL6416222 0.81 MMP1 (0.39) MMP1MMP9MMP8MMP3MMP2
SCHEMBL7431867 0.78 BMP1 (0.41) MMP1MMP2MMP13
SCHEMBL7358479 0.75 ALOX5 (0.44) MMP1MMP9MMP8MMP3MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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