SCHEMBL8638392

SCHEMBL8638392

CC(C)C[C@H](N[C@@H](CC(=O)Nc1ccccc1)C(=O)O)C(=O)N(c1ccc(-c2ccccc2)cc1)[C@@H](C)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45
SLC1A3 P43003 1/20 0.44
SLC1A2 P43004 1/20 0.44
SLC1A1 P43005 1/20 0.44
PTPN1 P18031 1/20 0.43
DGAT1 O75907 1/20 0.43
MMP3 P08254 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MMP9 P14780 3/20 0.39
TSHR P16473 2/20 0.39
MMP1 P03956 2/20 0.39
CTSB P07858 2/20 0.39
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
MMP2 P08253 1/20 0.38
MMP8 P22894 1/20 0.38
MMP12 P39900 1/20 0.38

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
SCHEMBL8639097 0.90 MMP9 (0.48) LMNAHPGDDGAT1MMP3MEN1
SCHEMBL8639821 0.90 MMP9 (0.48) LMNAHPGDDGAT1MMP3MEN1
SCHEMBL8642069 0.87 PTPN1 (0.41) LMNAHPGDSLC1A3SLC1A2SLC1A1
SCHEMBL8644830 0.86 MMP9 (0.42) LMNAHPGDMMP3MEN1KMT2A
SCHEMBL8638173 0.86 MMP9 (0.42) LMNAHPGDMMP3MEN1KMT2A
SCHEMBL8755957 0.84 LTA4H (0.44) LMNAHPGDDGAT1MMP3MEN1
SCHEMBL8637613 0.81 MME (0.55) HPGDMMP3MMP9MMP1ACE
SCHEMBL8638354 0.79 LTA4H (0.45) DGAT1MMP3MEN1KMT2AMMP9
Lithium Ion SCHEMBL8637659 0.79 MMP2 (0.44) DGAT1MMP3MEN1KMT2AMMP9
SCHEMBL8639883 0.79 LTA4H (0.45) DGAT1MMP3MEN1KMT2AMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0766694-B1 PEPTIDE DERIVATIVES WITH METALLOPEPTIDASE INHIBITORY ACTIVITY ZAMBON SPA (IT) 1998-08-05 EP disclosed