SCHEMBL9754023

SCHEMBL9754023

CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 7/20 0.62
POLB P06746 1/20 0.54
KMT2A Q03164 2/20 0.53
ACE P12821 1/20 0.50
CMA1 P23946 6/20 0.49
ATM Q13315 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 1/20 0.48

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
SCHEMBL9754021 1.00 REN (0.62) RENPOLBKMT2AACECMA1
SCHEMBL9754222 0.91 REN (0.54) RENPOLBKMT2AACEMEN1
SCHEMBL9754227 0.91 REN (0.54) RENPOLBKMT2AACEMEN1
SCHEMBL28067688 0.89 ACE (0.56) RENKMT2AACECMA1ATM
SCHEMBL28067687 0.89 ACE (0.56) RENKMT2AACECMA1ATM
SCHEMBL30279327 0.87 REN (0.54) RENPOLBKMT2AACECMA1
SCHEMBL30279311 0.84 POLB (0.54) RENPOLBKMT2AMEN1
SCHEMBL30689119 0.82 CTRB1 (0.56) RENKMT2AACECMA1MEN1
SCHEMBL13123112 0.82 POLB (0.56) POLBKMT2ACMA1L3MBTL1MEN1
SCHEMBL28379593 0.82 POLB (0.66) RENPOLBKMT2AL3MBTL1MEN1

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
WO-1991008221-A1 PEPTIDE INHIBITORS OF HIV PROTEASE WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1991-06-13 WO disclosed