SCHEMBL23230058

SCHEMBL23230058

CC[C@H](C)[C@H](NC(C)=O)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 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 2/20 0.43
▸ POLB P06746 1/20 0.39
▸ ACE P12821 1/20 0.39
▸ MLX Q9UH92 1/20 0.38
▸ ELANE P08246 4/20 0.38
▸ GZMB P10144 2/20 0.38
▸ CMA1 P23946 1/20 0.37
▸ DPP4 P27487 1/20 0.37
▸ DPP8 Q6V1X1 1/20 0.37
▸ DPP9 Q86TI2 1/20 0.37
▸ AGTR1 P30556 1/20 0.36
▸ ITGB3 P05106 1/20 0.36
▸ ITGA2B P08514 1/20 0.36
▸ PREP P48147 1/20 0.36
▸ FAP Q12884 1/20 0.36
▸ NTSR1 P30989 1/20 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
SCHEMBL23230057 1.00 XIAP (0.43) XIAPPOLBACEMLXELANE
SCHEMBL23230066 0.89 XIAP (0.45) XIAPPOLBACEMLXELANE
SCHEMBL23230061 0.89 XIAP (0.45) XIAPPOLBACEMLXELANE
SCHEMBL29567377 0.85 XIAP (0.47) XIAPPOLBACEMLXELANE
SCHEMBL29565370 0.85 XIAP (0.50) XIAPPOLBELANEDPP4DPP8
SCHEMBL1404295 0.85 ACE (0.41) XIAPACEMLXELANECMA1
SCHEMBL29411315 0.85 XIAP (0.42) XIAPACEMLXELANECMA1
SCHEMBL23229944 0.85 ACE (0.41) XIAPACEMLXELANECMA1
SCHEMBL1404290 0.85 ACE (0.41) XIAPACEMLXELANECMA1
SCHEMBL29411286 0.85 XIAP (0.48) XIAPPOLBACEMLXELANE

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 XIAP 3185/4885POLB 230/4885ACE 4849/4885

“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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