SCHEMBL24414076

SCHEMBL24414076

Cc1ccc(C(OC(=O)C[C@@H](C)NC(=O)OCC2c3ccccc3-c3ccccc32)(c2ccccc2)c2ccccc2Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.41
▸ MDM2 Q00987 1/20 0.40
▸ MDM4 O15151 2/20 0.40
▸ TP53 P04637 2/20 0.40
▸ FABP7 O15540 1/20 0.38
▸ FABP5 Q01469 1/20 0.38
▸ PTPN1 P18031 1/20 0.36
▸ KMT2A Q03164 2/20 0.36

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
SCHEMBL16574598 1.00 CASP3 (0.41) CASP3MDM2MDM4TP53FABP7
SCHEMBL28773107 0.96 CASP3 (0.44) CASP3MDM4TP53FABP7FABP5
SCHEMBL26666846 0.96 CASP3 (0.44) CASP3MDM4TP53FABP7FABP5
SCHEMBL25657661 0.90 CASP3 (0.39) CASP3MDM2MDM4TP53FABP7
SCHEMBL16574596 0.89 CASP3 (0.40) CASP3MDM2MDM4TP53FABP7
SCHEMBL25657670 0.89 CASP3 (0.39) CASP3MDM2MDM4TP53FABP7
SCHEMBL16574818 0.89 MDM4 (0.45) CASP3MDM2MDM4TP53
SCHEMBL23056549 0.88 CASP3 (0.38) CASP3MDM2MDM4TP53FABP7
SCHEMBL23056431 0.88 CASP3 (0.38) CASP3MDM2MDM4TP53FABP7
SCHEMBL23056550 0.88 CASP3 (0.38) CASP3MDM2MDM4TP53FABP7

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-20240239842-A1 BINDING MOLECULE EXHIBITING SELECTIVE BINDING FOR RAS(G12D) MUTANT CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-07-18 — — US disclosed
US-20240239842-A1 BINDING MOLECULE EXHIBITING SELECTIVE BINDING FOR RAS(G12D) MUTANT CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-07-18 — — US disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 — — US disclosed
WO-2022097540-A1 PEPTIDE SYNTHESIS METHOD FOR SUPPRESSING DEFECT CAUSED BY DIKETOPIPERAZINE FORMATION 中外製薬株式会社 2022-05-12 — — 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 (2 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-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS CASP3 3906/4885MDM2 164/4885MDM4 441/4885
US-20240239842-A1 BINDING MOLECULE EXHIBITING SELECTIVE BINDING FOR RAS(G12D) MUTANT KRAS, G3BP1, G3BP2 CASP3 4245/4885MDM2 47/4885MDM4 438/4885

“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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