SCHEMBL26970238

SCHEMBL26970238

COc1cc(C2CNC2)ccc1Nc1ncc(C(N)=O)c(Nc2ccccc2Br)n1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 10/20 0.61
▸ EGFR P00533 6/20 0.58
▸ ULK1 O75385 1/20 0.51
▸ MAPK8 P45983 1/20 0.50
▸ MAPK9 P45984 1/20 0.50
▸ MAPK10 P53779 1/20 0.50
▸ INSR P06213 1/20 0.49
▸ IGF1R P08069 1/20 0.49
▸ ALK Q9UM73 1/20 0.49
▸ MET P08581 1/20 0.49
▸ JAK2 O60674 1/20 0.49
▸ JAK1 P23458 1/20 0.49
▸ TYK2 P29597 1/20 0.49
▸ JAK3 P52333 1/20 0.49

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
SCHEMBL30689974 1.00 MAP4K1 (0.61) MAP4K1EGFRULK1MAPK8MAPK9
SCHEMBL26970210 0.94 EGFR (0.63) MAP4K1EGFRIGF1RALKMET
SCHEMBL30689961 0.94 EGFR (0.63) MAP4K1EGFRIGF1RALKMET
SCHEMBL29525992 0.83 EGFR (0.70) MAP4K1EGFRULK1MAPK8MAPK9
SCHEMBL29526496 0.80 MAP4K1 (0.73) MAP4K1ALK
SCHEMBL26970277 0.80 MAP4K1 (0.73) MAP4K1ALK
SCHEMBL26970215 0.80 EGFR (0.67) MAP4K1EGFRALKMET
SCHEMBL29526468 0.80 EGFR (0.67) MAP4K1EGFRALKMET
SCHEMBL29526647 0.79 MAP4K1 (0.65) MAP4K1MAPK8MAPK9INSRIGF1R
SCHEMBL26970158 0.79 MAP4K1 (0.65) MAP4K1MAPK8MAPK9INSRIGF1R

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 59/4885EGFR 4265/4885ULK1 86/4885

“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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