SCHEMBL30468161

SCHEMBL30468161

COC(=O)[C@H](Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 13/20 0.55
▸ MDM4 O15151 2/20 0.51
▸ TP53 P04637 2/20 0.51
▸ NMBR P28336 1/20 0.45
▸ MDM2 Q00987 1/20 0.44

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
SCHEMBL29368020 0.93 MDM4 (0.54) SIRT2MDM4TP53MDM2
SCHEMBL13227674 0.93 MDM4 (0.54) SIRT2MDM4TP53MDM2
SCHEMBL30433831 0.93 MDM4 (0.54) SIRT2MDM4TP53MDM2
SCHEMBL1737899 0.93 MDM4 (0.54) SIRT2MDM4TP53MDM2
SCHEMBL12994493 0.93 MDM4 (0.54) SIRT2MDM4TP53MDM2
SCHEMBL29399601 0.92 SIRT2 (0.49) SIRT2MDM4TP53NMBR
SCHEMBL28913050 0.92 SIRT2 (0.49) SIRT2MDM4TP53NMBR
SCHEMBL28913051 0.92 SIRT2 (0.49) SIRT2MDM4TP53NMBR
SCHEMBL26556264 0.90 SIRT2 (0.46) SIRT2MDM4TP53NMBRMDM2
SCHEMBL17991594 0.90 MDM2 (0.54) SIRT2MDM4TP53MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4656245-A1 HISTIDINE-BASED UNNATURAL AMINO ACID, ITS PRODUCTION AND USE PHILIPPS-UNIVERSITÄT MARBURG (DE) 2025-12-03 — — EP disclosed
EP-4448547-A1 APELINERGIC MACROCYCLES AND USES THEREOF Socpra Sciences Santé Et Humaines S.E.C. (CA) 2024-10-23 — — EP disclosed
US-20240343761-A1 APELINERGIC MACROCYCLES AND USES THEREOF SOCPRA SCIENCES SANTÉ ET HUMAINES S.E.C. (CA) 2024-10-17 — — US disclosed
WO-2023108291-A9 APELINERGIC MACROCYCLES AND USES THEREOF SOCPRA SCIENCES SANTÉ ET HUMAINES S.E.C. (CA) 2023-09-28 — — WO disclosed
WO-2023108291-A1 APELINERGIC MACROCYCLES AND USES THEREOF SOCPRA SCIENCES SANTÉ ET HUMAINES S.E.C. (CA) 2023-06-22 — — 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-20240343761-A1 APELINERGIC MACROCYCLES AND USES THEREOF APLNR, AP3D1, AP3B1 SIRT2 2328/4885MDM4 4826/4885TP53 4848/4885

“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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