SCHEMBL30758115

SCHEMBL30758115

C[C@@H](O)[C@H](NC(=O)[C@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 8/20 0.45
MDM4 O15151 1/20 0.43
TP53 P04637 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
SCHEMBL30758116 0.91 PTPN1 (0.45) PTPN1MDM4TP53
SCHEMBL29812486 0.91 MDM4 (0.43) PTPN1MDM4TP53
SCHEMBL18764578 0.90 CASP3 (0.49) PTPN1MDM4TP53
SCHEMBL29812711 0.90 MDM4 (0.48) PTPN1MDM4TP53
SCHEMBL29483556 0.90 MDM4 (0.48) PTPN1MDM4TP53
SCHEMBL29372762 0.89 PTPN1 (0.50) PTPN1MDM4TP53
SCHEMBL20545940 0.88 MDM4 (0.45) PTPN1MDM4TP53
SCHEMBL13424242 0.88 PTPN1 (0.48) PTPN1MDM4TP53
SCHEMBL2199171 0.87 PTPN1 (0.44) PTPN1MDM4TP53
SCHEMBL2199165 0.87 PTPN1 (0.44) PTPN1MDM4TP53

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
US-20230416329-A1 A PEPTIDE WITH DISULFIDE BONDS AND INHIBITORY ACTIVITY AGAINST SERINE PROTEASES, DERIVED HYBRID PEPTIDES THEREOF, AND USES THEREOF INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2023-12-28 US 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-20230416329-A1 A PEPTIDE WITH DISULFIDE BONDS AND INHIBITORY ACTIVITY AGAINST SERINE PROTEASES, DERIVED HYBRID PEPTIDES THEREOF, AND USES THEREOF VIP, SI, TMPRSS15 PTPN1 2678/4885MDM4 4066/4885TP53 1459/4885

“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.