SCHEMBL29696607

SCHEMBL29696607

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

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.34
▸ FABP5 Q01469 3/20 0.34
▸ FABP7 O15540 2/20 0.34
▸ MDM4 O15151 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CTSL P07711 1/20 0.33
▸ CTSB P07858 1/20 0.33
▸ CTSS P25774 1/20 0.33
▸ CTSK P43235 1/20 0.33
▸ CASP3 P42574 3/20 0.33
▸ PTPN1 P18031 1/20 0.31
▸ EPHX2 P34913 1/20 0.31

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
SCHEMBL29696684 0.90 KMT2A (0.40) KMT2AFABP5FABP7MDM4TP53
SCHEMBL29697697 0.88 KMT2A (0.38) KMT2AFABP5FABP7MDM4TP53
SCHEMBL29696614 0.88 KMT2A (0.38) KMT2AFABP5FABP7MDM4TP53
SCHEMBL24579340 0.88 KMT2A (0.38) KMT2AFABP5FABP7MDM4TP53
SCHEMBL26605892 0.88 KMT2A (0.38) KMT2AFABP5FABP7MDM4TP53
SCHEMBL24579341 0.88 KMT2A (0.38) KMT2AFABP5FABP7MDM4TP53
SCHEMBL24580465 0.87 KMT2A (0.40) KMT2AFABP5FABP7CTSLCTSB
SCHEMBL29696708 0.85 CASP3 (0.40) KMT2AMDM4TP53CTSLCTSB
SCHEMBL24579143 0.83 KMT2A (0.35) KMT2AFABP5FABP7CTSLCTSB
SCHEMBL24579145 0.83 KMT2A (0.35) KMT2AFABP5FABP7CTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124517-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-04-18 — — US disclosed
EP-4269422-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-11-01 — — EP disclosed
CN-116615411-A Process for producing peptide compound containing N-substituted amino acid residue 中外制药株式会社 2023-08-18 — — CN disclosed
WO-2022138891-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE 中外製薬株式会社 2022-06-30 — — 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-20240124517-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND CONTAINING N-SUBSTITUTED-AMINO ACID RESIDUE VIP, NPEPPS, ANPEP KMT2A 2123/4885FABP5 2937/4885FABP7 2803/4885

“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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