SCHEMBL25718145

SCHEMBL25718145

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

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.51
▸ TLR2 O60603 2/20 0.48
▸ MDM4 O15151 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ KMT2A Q03164 2/20 0.47
▸ PIN1 Q13526 1/20 0.47
▸ MDM2 Q00987 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
SCHEMBL25718137 1.00 CASP3 (0.51) CASP3TLR2MDM4TP53KMT2A
SCHEMBL25718136 1.00 CASP3 (0.51) CASP3TLR2MDM4TP53KMT2A
SCHEMBL25718138 1.00 CASP3 (0.51) CASP3TLR2MDM4TP53KMT2A
SCHEMBL31370336 0.93 TLR2 (0.51) CASP3TLR2MDM4TP53KMT2A
SCHEMBL31370098 0.93 TLR2 (0.51) CASP3TLR2MDM4TP53KMT2A
SCHEMBL118209 0.91 CASP3 (0.52) CASP3MDM4TP53KMT2APIN1
SCHEMBL1564185 0.91 CASP3 (0.52) CASP3MDM4TP53KMT2APIN1
SCHEMBL6038102 0.91 CASP3 (0.52) CASP3MDM4TP53KMT2APIN1
SCHEMBL1486287 0.91 CASP3 (0.52) CASP3MDM4TP53KMT2APIN1
SCHEMBL30896049 0.91 CASP3 (0.52) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174576-A1 BETA-STRAND BRIDGE PEPTIDE KYOTO UNIVERSITY (JP) 2023-06-08 — — 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-20230174576-A1 BETA-STRAND BRIDGE PEPTIDE IAPP, SPPL2B, VIP CASP3 2595/4885TLR2 4336/4885MDM4 1478/4885

“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.

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