SCHEMBL377861

SCHEMBL377861

C[C@H](C(=O)O)C(CO)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.52
MDM4 O15151 2/20 0.49
TP53 P04637 2/20 0.49
KMT2A Q03164 2/20 0.49
PIN1 Q13526 1/20 0.46
EPHX2 P34913 1/20 0.46
TLR2 O60603 1/20 0.45

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
SCHEMBL2133922 1.00 CASP3 (0.52) CASP3MDM4TP53KMT2APIN1
SCHEMBL6762639 0.89 KMT2A (0.52) CASP3MDM4TP53KMT2APIN1
SCHEMBL29402087 0.89 KMT2A (0.52) CASP3MDM4TP53KMT2APIN1
SCHEMBL15960134 0.89 KMT2A (0.52) CASP3MDM4TP53KMT2APIN1
SCHEMBL20371129 0.88 KMT2A (0.51) CASP3MDM4TP53KMT2APIN1
SCHEMBL29401003 0.88 KMT2A (0.51) CASP3MDM4TP53KMT2APIN1
SCHEMBL29367499 0.88 KMT2A (0.51) CASP3MDM4TP53KMT2APIN1
SCHEMBL15087402 0.88 KMT2A (0.51) CASP3MDM4TP53KMT2APIN1
SCHEMBL6796003 0.86 MDM4 (0.52) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL29400949 0.85 CASP3 (0.49) CASP3MDM4TP53KMT2APIN1

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-20120101257-A1 PROCESSES FOR PREPARING AMINO-SUBSTITUTED GAMMA-LACTAMS UNIVERSITE DE MONTREAL (CA) 2012-04-26 US disclosed
EP-2408759-A1 PROCESSES FOR PREPARING AMINO-SUBSTITUTED GAMMA-LACTAMS Valorisation-Recherche, Société en Commandite (CA) 2012-01-25 EP disclosed
WO-2010105367-A1 PROCESSES FOR PREPARING AMINO-SUBSTITUTED GAMMA-LACTAMS VALORISATION-RECHERCHE SOCIETE EN COMMANDITE (CA) 2010-09-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120101257-A1 PROCESSES FOR PREPARING AMINO-SUBSTITUTED GAMMA-LACTAMS QPCT, GLUL, ASNS CASP3 4203/4885MDM4 2866/4885TP53 3488/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.