SCHEMBL25660357

SCHEMBL25660357

COC(=O)c1cn(Cc2ccc(Cn3cc(F)ccc3=O)c(F)c2)nc1C1COC1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 16/20 0.42
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PTGDR2 Q9Y5Y4 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
SCHEMBL24863509 0.92 KLKB1 (0.38) KLKB1PTGDR2
SCHEMBL24863510 0.90 KLKB1 (0.38) KLKB1PTGDR2
SCHEMBL25659783 0.89 KLKB1 (0.52) KLKB1
SCHEMBL25659967 0.85 KLKB1 (0.42) KLKB1MEN1KMT2A
SCHEMBL24863503 0.84 KLKB1 (0.64) KLKB1
SCHEMBL25660016 0.83 KLKB1 (0.41) KLKB1PTGDR2
SCHEMBL24863526 0.83 KLKB1 (0.64) KLKB1
SCHEMBL24863505 0.82 KLKB1 (0.43) KLKB1
SCHEMBL24863398 0.82 KLKB1 (0.52) KLKB1
SCHEMBL25659921 0.82 KLKB1 (0.42) KLKB1

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-20230167098-A1 HETEROCYCLIC COMPOUND MEDSHINE DISCOVERY INC. (CN) 2023-06-01 — — 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-20230167098-A1 HETEROCYCLIC COMPOUND CYP11B2, CYP4F11, CYP11B1 KLKB1 1724/4885MEN1 511/4885KMT2A 4628/4885

“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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