SCHEMBL22930531

SCHEMBL22930531

C/N=C(/NC)NCCC[C@H](NCC(=O)[C@H](CCCNC(N)=O)NCC(=O)[C@H](CCCC(C)C)NC)C(C)=O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.35

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
SCHEMBL20857557 0.94 KDM1A (0.39) KDM1A
SCHEMBL25138026 0.90 KDM1A (0.33) KDM1A
SCHEMBL20369486 0.89 KISS1R (0.33) —
SCHEMBL21842544 0.85 KDM1A (0.38) KDM1A
SCHEMBL22878504 0.80 KISS1R (0.35) —
SCHEMBL15316693 0.78 KDM1A (0.51) KDM1A
SCHEMBL21286775 0.75 CSK (0.35) —
SCHEMBL10441955 0.72 C3AR1 (0.38) —
SCHEMBL15315075 0.72 C3AR1 (0.38) —
SCHEMBL15691795 0.72 C3AR1 (0.38) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230127248-A1 PEPTIDOMIMETIC MACROCYCLES AND FORMULATIONS THEREOF AILERON THERAPEUTICS, INC. 2023-04-27 — — US disclosed
US-10905739-B2 Peptidomimetic macrocycles and formulations thereof AILERON THERAPEUTICS, INC. (US) 2021-02-02 — — 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 (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-20230127248-A1 PEPTIDOMIMETIC MACROCYCLES AND FORMULATIONS THEREOF MDM2, TP53, TP53BP1 KDM1A 3908/4885
US-10905739-B2 Peptidomimetic macrocycles and formulations thereof MDM2, TP53, TP53BP1 KDM1A 3908/4885

“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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