SCHEMBL23081569

SCHEMBL23081569

CC(=O)NC(Cc1ccccc1)C(=O)NC(CC(C)C)C(=O)NC(C(=O)NC(CC(=O)O)C(=O)CCl)C(C)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 5/20 0.49
▸ BACE2 Q9Y5Z0 3/20 0.49
▸ REN P00797 3/20 0.49
▸ KEAP1 Q14145 3/20 0.48
▸ OPRM1 P35372 1/20 0.47
▸ OPRD1 P41143 1/20 0.47
▸ CPA1 P15085 1/20 0.46
▸ CPB1 P15086 1/20 0.46
▸ CPA2 P48052 1/20 0.46
▸ CPA4 Q9UI42 1/20 0.46
▸ ACE2 Q9BYF1 1/20 0.46
▸ PSMB5 P28074 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ KISS1R Q969F8 1/20 0.45

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
SCHEMBL31119957 1.00 BACE1 (0.49) BACE1BACE2RENKEAP1OPRM1
SCHEMBL29991514 0.90 BACE1 (0.53) BACE1BACE2RENKEAP1OPRM1
SCHEMBL31609331 0.85 MME (0.56) RENOPRM1OPRD1CPA1CPB1
SCHEMBL29886195 0.81 BACE1 (0.55) BACE1BACE2RENOPRM1OPRD1
SCHEMBL30190513 0.78 KEAP1 (0.67) BACE1BACE2KEAP1OPRM1OPRD1
SCHEMBL30799592 0.77 OPRM1 (0.60) BACE1BACE2OPRM1OPRD1
SCHEMBL7421185 0.77 CPA1 (0.59) BACE1BACE2CPA1CPB1CPA2
SCHEMBL18087495 0.77 CASP1 (0.63) BACE1BACE2RENOPRD1
SCHEMBL24310825 0.77 CASP1 (0.63) BACE1BACE2RENOPRD1
SCHEMBL19970821 0.77 CASP1 (0.63) BACE1BACE2RENOPRD1

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-11752196-B2 Treatment of pyroptosis JALAN RAJIV (GB) 2023-09-12 — — US disclosed
US-20210069296-A1 TREATMENT OF PYROPTOSIS JALAN RAJIV (GB) 2021-03-11 — — 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-11752196-B2 Treatment of pyroptosis GSDMD, CASP1, CASP5 BACE1 345/4885BACE2 1553/4885REN 2008/4885
US-20210069296-A1 TREATMENT OF PYROPTOSIS GSDMD, CASP1, CASP5 BACE1 345/4885BACE2 1553/4885REN 2008/4885

“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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