SCHEMBL23229944

SCHEMBL23229944

CC(C)C(N)C(=O)NCC(=O)NC(C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)O)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 1/20 0.41
▸ XIAP P98170 2/20 0.41
▸ MLX Q9UH92 1/20 0.41
▸ ELANE P08246 8/20 0.40
▸ CMA1 P23946 1/20 0.39
▸ CALCRL Q16602 4/20 0.37

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
SCHEMBL1404290 1.00 ACE (0.41) ACEXIAPMLXELANECMA1
SCHEMBL1404295 1.00 ACE (0.41) ACEXIAPMLXELANECMA1
SCHEMBL23229943 0.97 ACE (0.39) ACEXIAPMLXELANECMA1
SCHEMBL29411315 0.96 XIAP (0.42) ACEXIAPMLXELANECMA1
Trifluoroacetic Acid SCHEMBL30641540 0.95 ELANE (0.44) ACEXIAPMLXELANECMA1
SCHEMBL30102197 0.94 XIAP (0.41) ACEXIAPMLXELANECMA1
SCHEMBL23230066 0.93 XIAP (0.45) ACEXIAPMLXELANECMA1
SCHEMBL23230061 0.93 XIAP (0.45) ACEXIAPMLXELANECMA1
SCHEMBL664013 0.92 ELANE (0.47) ACEXIAPMLXELANECMA1
SCHEMBL664014 0.92 ELANE (0.47) ACEXIAPMLXELANECMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210106506-A1 METHODS FOR COSMETIC SKIN REMODELING ELC MANAGEMENT LLC 2021-04-15 — — 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-20210106506-A1 METHODS FOR COSMETIC SKIN REMODELING CUTA, PLOD3, KRT18 ACE 4849/4885XIAP 3185/4885MLX 4307/4885

“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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