SCHEMBL27102076

SCHEMBL27102076

CCC(=O)OCn1c(=O)c2c(ccn2COC(=O)CNC(=O)OC(C)(C)C)n(CCOC(C)C)c1=S

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ GAA P10253 1/20 0.30

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
SCHEMBL27103572 0.97 OPRM1 (0.32) KDM4E
SCHEMBL27102078 0.82 MPO (0.45) KDM4E
SCHEMBL23217963 0.81 POLB (0.38) GAA
SCHEMBL23225604 0.81 MPO (0.35) KDM4E
SCHEMBL27102074 0.80 LMNA (0.33) —
SCHEMBL23225676 0.76 MPO (0.42) KDM4EGAA
SCHEMBL23225712 0.76 POLB (0.33) —
SCHEMBL23218019 0.76 OPRM1 (0.32) —
SCHEMBL23217931 0.76 OPRM1 (0.40) KDM4EGAA
SCHEMBL23225679 0.75 — —

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-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS BIOHAVEN THERAPEUTICS LTD. 2024-02-29 — — 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-20240067651-A1 PRODRUGS OF MYELOPEROXIDASE INHIBITORS MPO, CAT, SOD1 KDM4E 2809/4885GAA 44/4885

“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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