SCHEMBL30558184

SCHEMBL30558184

CC(C)[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CN)C(C)C)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 2/20 0.43
▸ MLX Q9UH92 1/20 0.42
▸ ELANE P08246 6/20 0.40
▸ ACE P12821 2/20 0.39
▸ F2 P00734 1/20 0.37
▸ CMA1 P23946 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ REN P00797 1/20 0.36
▸ AGTR1 P30556 1/20 0.36
▸ TAAR1 Q96RJ0 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
SCHEMBL13567377 0.91 XIAP (0.44) XIAPMLXELANEF2CMA1
SCHEMBL31615113 0.91 XIAP (0.44) XIAPMLXELANEACEF2
SCHEMBL30358379 0.91 ELANE (0.46) XIAPMLXELANEF2POLB
SCHEMBL30358374 0.88 REN (0.45) ACEF2REN
SCHEMBL30263777 0.85 REN (0.50) ACEF2REN
SCHEMBL29411300 0.85 ELANE (0.46) XIAPMLXELANEACECMA1
SCHEMBL29966881 0.85 REN (0.46) ACEF2REN
SCHEMBL30511655 0.85 XIAP (0.49) XIAPMLXELANEPOLBREN
SCHEMBL23229944 0.85 ACE (0.41) XIAPMLXELANEACECMA1
SCHEMBL1404295 0.85 ACE (0.41) XIAPMLXELANEACECMA1

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-20240041740-A1 SKIN PEEL COMPOSITIONS GLO PHARMA INC (US) 2024-02-08 — — US disclosed
US-20230270635-A1 METHODS AND COMPOSITIONS FOR COSMETIC APPLICATIONS GLO PHARMA INC (US) 2023-08-31 — — 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-20230270635-A1 METHODS AND COMPOSITIONS FOR COSMETIC APPLICATIONS CUTA, GLA, LIPA XIAP 4200/4885MLX 2416/4885ELANE 127/4885

“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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