SCHEMBL25659772

SCHEMBL25659772

CCOC(=O)c1cn(Cc2ccc(CC3C=C(F)C=CC3=O)nc2)nc1C1COC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 8/20 0.32
▸ GRM2 Q14416 1/20 0.32
▸ ELANE P08246 1/20 0.30
▸ MAPT P10636 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
SCHEMBL25659962 0.91 KLKB1 (0.32) KLKB1ELANEMAPT
SCHEMBL25659947 0.81 ELANE (0.37) KLKB1GRM2ELANEMAPT
SCHEMBL24863528 0.80 KLKB1 (0.38) KLKB1GRM2
SCHEMBL24863354 0.79 CA12 (0.36) KLKB1GRM2ELANEMAPT
SCHEMBL24863355 0.78 LMNA (0.38) KLKB1ELANEMAPT
SCHEMBL25659769 0.76 KLKB1 (0.46) KLKB1
SCHEMBL24863505 0.74 KLKB1 (0.43) KLKB1GRM2MAPT
SCHEMBL25659967 0.72 KLKB1 (0.42) KLKB1
SCHEMBL24863520 0.71 KLKB1 (0.52) KLKB1
SCHEMBL25659886 0.70 KLKB1 (0.38) KLKB1MAPT

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 1724/4885GRM2 4240/4885ELANE 2441/4885

“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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