SCHEMBL29633955

SCHEMBL29633955

CN(C(=O)OCC1c2ccccc2-c2ccccc21)C(Cc1cncc(F)c1)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 3/20 0.37
TP53 P04637 3/20 0.37
MDM2 Q00987 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
PTGIR P43119 1/20 0.36
FABP5 Q01469 3/20 0.35
FABP7 O15540 2/20 0.35
EPHX2 P34913 1/20 0.34
KMT2A Q03164 2/20 0.34
CASP3 P42574 1/20 0.34
S1PR3 Q99500 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL31754272 1.00 MDM4 (0.37) MDM4TP53MDM2ITGB3ITGA2B
SCHEMBL29633729 0.91 MDM4 (0.36) MDM4TP53MDM2PTGIRFABP5
SCHEMBL25178688 0.89 PTGIR (0.37) MDM4TP53MDM2ITGB3ITGA2B
SCHEMBL29855063 0.89 PTGIR (0.37) MDM4TP53MDM2ITGB3ITGA2B
SCHEMBL31369929 0.89 EPHX2 (0.39) MDM4TP53ITGB3ITGA2BFABP5
SCHEMBL25179560 0.89 PTGIR (0.37) MDM4TP53MDM2ITGB3ITGA2B
SCHEMBL29633721 0.89 PTGIR (0.37) MDM4TP53MDM2ITGB3ITGA2B
SCHEMBL31370344 0.89 FABP5 (0.38) MDM4TP53MDM2ITGB3ITGA2B
SCHEMBL21837615 0.89 MDM4 (0.37) MDM4TP53MDM2ITGB3ITGA2B
SCHEMBL21837613 0.89 MDM4 (0.37) MDM4TP53MDM2ITGB3ITGA2B

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-20240376044-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2024-11-14 US disclosed
US-12071396-B2 Method for preparing aromatic amino acid derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-08-27 US disclosed
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-05-12 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 (3 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-20240376044-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR MDM4 381/4885TP53 1369/4885MDM2 223/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR MDM4 381/4885TP53 1369/4885MDM2 223/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR MDM4 381/4885TP53 1369/4885MDM2 223/4885

“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.