SCHEMBL7397759

SCHEMBL7397759

CNC(=O)[C@H](Cc1ccccc1)N(C(=O)CCCCCN1C(=O)c2ccccc2C1=O)C(=O)[C@@H](N)CC(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 6/20 0.49
MMP2 P08253 5/20 0.49
MMP1 P03956 4/20 0.49
MMP7 P09237 3/20 0.49
MMP9 P14780 3/20 0.49
MMP14 P50281 3/20 0.49
HPGD P15428 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ELANE P08246 1/20 0.41
HDAC8 Q9BY41 5/20 0.41
HDAC3 O15379 4/20 0.41
HDAC1 Q13547 4/20 0.41
HDAC11 Q96DB2 4/20 0.41
HDAC6 Q9UBN7 4/20 0.41
HDAC4 P56524 3/20 0.41
HDAC7 Q8WUI4 3/20 0.41
HDAC2 Q92769 3/20 0.41
HDAC10 Q969S8 3/20 0.41
HDAC9 Q9UKV0 3/20 0.41
HDAC5 Q9UQL6 3/20 0.41

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
SCHEMBL7402161 0.99 MMP3 (0.48) MMP3MMP2MMP1MMP7MMP9
SCHEMBL7403302 0.96 MMP1 (0.48) MMP3MMP2MMP1MMP7MMP9
SCHEMBL7397719 0.93 ELANE (0.44) MMP3MMP2MMP1MMP7MMP9
SCHEMBL7403845 0.89 HPGD (0.43) MMP3MMP2MMP1MMP7MMP9
SCHEMBL7593717 0.84 ELANE (0.44) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8511173 0.82 MMP3 (0.42) MMP3MMP2MMP1MMP7MMP9
SCHEMBL7595170 0.82 ELANE (0.46) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8510054 0.81 ANPEP (0.43) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8508599 0.81 MMP3 (0.42) MMP3MMP2MMP1MMP7MMP9
SCHEMBL8764880 0.80 ANPEP (0.42) MMP3MMP2MMP1MMP7MMP9

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
WO-1996035711-A1 PEPTIDE COMPOUNDS WHICH INHIBIT METALLOPROTEINASE AND TNF LIBERATION, AND THEIR THERAPEUTIC USE CHIROSCIENCE LIMITED (GB) 1996-11-14 WO claimed
US-5981491-A PEPTIDES; METALLOENZYMES; TUMOR NECROSIS FACTOR DARWIN DISCOVERY LIMITED (GB) 1999-11-09 US disclosed
EP-0824543-A1 PEPTIDE COMPOUNDS WHICH INHIBIT METALLOPROTEINASE AND TNF LIBERATION, AND THEIR THERAPEUTIC USE Chiroscience Limited (GB) 1998-02-25 EP disclosed
WO-1996035711-A1 PEPTIDE COMPOUNDS WHICH INHIBIT METALLOPROTEINASE AND TNF LIBERATION, AND THEIR THERAPEUTIC USE CHIROSCIENCE LIMITED (GB) 1996-11-14 WO disclosed