SCHEMBL8610212

SCHEMBL8610212

CP(=O)(OC(=O)[C@@H](N)Cc1ccccc1)OC(=O)[C@@H](N)Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
LAP3 P28838 5/20 0.50
SLC15A1 P46059 2/20 0.49
ANPEP P15144 3/20 0.49
LTA4H P09960 1/20 0.46
SLC1A3 P43003 2/20 0.45
SLC1A2 P43004 2/20 0.45
SLC1A1 P43005 2/20 0.45
HDAC8 Q9BY41 1/20 0.44
SRR Q9GZT4 1/20 0.44
RNPEP Q9H4A4 1/20 0.43
DNPEP Q9ULA0 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL4958184 0.85 ALPI (0.58) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL4748271 0.85 ALPI (0.58) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL4748266 0.85 ALPI (0.58) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL4748270 0.84 ALPI (0.56) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL29761129 0.84 ALPI (0.56) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL19658097 0.83 LAP3 (0.57) ALPIPKMPTGS1XIAPSLC7A5
Phosphoramidic Acid SCHEMBL13858640 0.83 ALPI (0.54) ALPIPKMPTGS1XIAPSLC7A5
Phosphoramidic Acid SCHEMBL1691253 0.83 ALPI (0.54) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL7868422 0.81 ALPI (0.53) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL2785098 0.81 SLC7A5 (0.70) ALPIPKMPTGS1XIAPSLC7A5

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
US-5723576-A POLYPEPTIDES FOR ENZYME INHIBITORS AND HIRUNDIN DEVELOPMENT BIOTECHNOLOGICAL PROCESSES S.N.C. (IT) 1998-03-03 US disclosed
EP-0804470-A1 THROMBIN INHIBITORS, THE PREPARATION THEREOF AND THE USE THEREOF FOR THERAPEUTICAL, PROPHYLACTIC AND DIAGNOSTIC APPLICATIONS DEVELOPMENT BIOTECHNOLOGICAL PROCESSES S.N.C. DI PELLICCIA MARIA TERESA (IT) 1997-11-05 EP disclosed
WO-1994024156-A1 THROMBIN INHIBITORS, THE PREPARATION THEREOF AND THE USE THEREOF FOR THERAPEUTICAL, PROPHYLACTIC AND DIAGNOSTIC APPLICATIONS DEVELOPMENT BIOTECHNOLOGICAL PROCESSES S.N.C. DI PELLICCIA MARIA TERESA (IT) 1994-10-27 WO disclosed