SCHEMBL26970230

SCHEMBL26970230

COc1cc2c(cc1Nc1ncc(C(N)=O)c(Nc3c(C)cccc3F)n1)CNCC2

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 18/20 0.75
▸ BTK Q06187 1/20 0.59
▸ JAK1 P23458 1/20 0.54
▸ TYK2 P29597 1/20 0.54
▸ JAK3 P52333 1/20 0.54

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
SCHEMBL29526902 1.00 MAP4K1 (0.75) MAP4K1BTKJAK1TYK2JAK3
SCHEMBL26970348 0.95 MAP4K1 (0.73) MAP4K1BTK
SCHEMBL30689930 0.95 MAP4K1 (0.73) MAP4K1BTK
SCHEMBL30689925 0.87 MAP4K1 (0.61) MAP4K1BTK
SCHEMBL26970280 0.87 MAP4K1 (0.61) MAP4K1BTK
SCHEMBL29526518 0.85 MAP4K1 (1.00) MAP4K1
SCHEMBL26970358 0.85 MAP4K1 (1.00) MAP4K1
SCHEMBL29526496 0.83 MAP4K1 (0.73) MAP4K1
SCHEMBL26970277 0.83 MAP4K1 (0.73) MAP4K1
SCHEMBL29526220 0.81 MAP4K1 (0.78) MAP4K1

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-20230416225-A1 DIAMINOPYRIMIDINE CARBOXAMIDE INHIBITORS OF HPK1 MERCK SHARP & DOHME LLC (US) 2023-12-28 — — 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-20230416225-A1 DIAMINOPYRIMIDINE CARBOXAMIDE INHIBITORS OF HPK1 PDXK, PHKG1, PHKG2 MAP4K1 59/4885BTK 3056/4885JAK1 1576/4885

“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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