SCHEMBL8640412

SCHEMBL8640412

CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](CC(C)C)C(=O)N(c1ccc(-c2ccccc2)cc1)[C@@H](C)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
REN P00797 2/20 0.46
ACE P12821 11/20 0.42
LMNA P02545 2/20 0.42
MME P08473 1/20 0.42
ABCB11 O95342 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
USP2 O75604 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
PDE3A Q14432 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 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
SCHEMBL8639909 0.95 REN (0.43) RENACELMNAMMEABCB11
SCHEMBL8644979 0.95 REN (0.42) RENACELMNAMMEABCB11
SCHEMBL8638062 0.95 REN (0.42) RENACELMNAMMEABCB11
SCHEMBL8756920 0.93 REN (0.47) RENACELMNAMMEABCB11
SCHEMBL8645002 0.92 REN (0.41) RENACELMNAMME
SCHEMBL8642399 0.92 NPC1 (0.39) RENACEMMEMEN1KMT2A
SCHEMBL8638508 0.92 NPC1 (0.39) RENACEMMEMEN1KMT2A
SCHEMBL8636757 0.91 MME (0.50) ACELMNAMMEABCB11SMN1; SMN2
SCHEMBL8639879 0.87 ACE (0.42) ACELMNAMMEABCB11SMN1; SMN2
SCHEMBL8639130 0.86 ANPEP (0.44) MEN1KMT2ATAS1R3TAS1R1

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