SCHEMBL21243785

SCHEMBL21243785

O=C(N[C@H](C(=O)O)C(O)c1ccccc1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.50
▸ MDM4 O15151 3/20 0.50
▸ TP53 P04637 3/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ EPHX2 P34913 1/20 0.47
▸ MDM2 Q00987 1/20 0.43
▸ FABP7 O15540 1/20 0.43
▸ FABP5 Q01469 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
SCHEMBL17703894 1.00 CASP3 (0.50) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL12069026 1.00 CASP3 (0.50) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL31000491 1.00 CASP3 (0.50) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL9995014 1.00 CASP3 (0.50) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL31000492 0.92 MDM4 (0.48) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL31080829 0.92 MDM4 (0.48) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL12067889 0.90 CASP3 (0.51) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL15317927 0.90 CASP3 (0.51) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL31000653 0.90 KMT2A (0.46) CASP3MDM4TP53KMT2AEPHX2
SCHEMBL31037753 0.90 KMT2A (0.46) CASP3MDM4TP53KMT2AEPHX2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240057599-A1 METHODS FOR IMPROVING FRUIT QUALITY THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2024-02-22 — — US disclosed
US-11812746-B2 Method of controlling fungal infections in plants THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2023-11-14 — — US disclosed
US-20230330064-A1 TYROSINE, TRYPTOPHAN AND PHENYLALANINE AS mTOR AGONISTS MEDIATING PROTEASOME DYNAMICS, COMPOSITIONS, METHODS AND USES THEREOF IN THERAPY, AND PROGNOSTIC METHODS FOR DRUG-RESISTANCE RAMBAM MED-TECH LTD. (IL) 2023-10-19 — — US disclosed
EP-3825324-A1 CO-AGONISTS OF THE GLUCAGON AND GLP-1 RECEPTORS Merck Sharp & Dohme Corp. (US) 2021-05-26 — — EP disclosed
US-20200383327-A1 METHOD OF IMPROVING PLANT PERFORMANCE THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2020-12-10 — — US disclosed
US-20190246639-A1 METHOD OF CONTROLLING FUNGAL INFECTIONS IN PLANTS THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCHORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2019-08-15 — — 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-20230330064-A1 TYROSINE, TRYPTOPHAN AND PHENYLALANINE AS mTOR AGONISTS MEDIATING PROTEASOME DYNAMICS, COMPOSITIONS, METHODS AND USES THEREOF IN THERAPY, AND PROGNOSTIC METHODS FOR DRUG-RESISTANCE RPTOR, PSMG3, MTOR CASP3 3017/4885MDM4 1267/4885TP53 106/4885

“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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