SCHEMBL26640804

SCHEMBL26640804

CC1c2nc(N)ncc2CCN1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.41
PIK3R1 P27986 16/20 0.40
PIK3CA P42336 16/20 0.40
MAP4K4 O95819 1/20 0.39
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 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
SCHEMBL22999928 0.81 MAP4K4 (0.39) NR1H2PIK3R1PIK3CAMAP4K4MAPT
SCHEMBL30954006 0.75 NR1H2 (0.41) NR1H2PIK3R1PIK3CAMAPT
SCHEMBL27458686 0.75 NR1H2 (0.41) NR1H2PIK3R1PIK3CAMAPT
SCHEMBL23794836 0.75 NR1H2 (0.39) NR1H2MAPTMEN1KMT2A
SCHEMBL26640067 0.75 MAPT (0.45) MAPT
SCHEMBL23415871 0.75 SMN1; SMN2 (0.41) NR1H2MAPTMEN1KMT2A
SCHEMBL22999763 0.75 DDB1 (0.40) NR1H2PIK3R1PIK3CAMAP4K4MAPT
SCHEMBL25279581 0.74 ESR2 (0.39) NR1H2MEN1KMT2A
SCHEMBL21594081 0.74 SMN1; SMN2 (0.41) NR1H2MAPTMEN1KMT2A
SCHEMBL22803887 0.73 NR1H2 (0.54) NR1H2PIK3R1PIK3CAMAP4K4MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4522618-A1 TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES COMPOUNDS AS HPK1 INHIBITORS Merck Patent GmbH (DE) 2025-03-19 EP disclosed
US-20240025922-A1 TETRAHYDROPYRIDO[3,4-d]PYRIMIDINES AS HPK1 INHIBITORS MERCK HEALTHCARE KGAA (DE) 2024-01-25 US disclosed
US-20240025922-A1 TETRAHYDROPYRIDO[3,4-d]PYRIMIDINES AS HPK1 INHIBITORS MERCK HEALTHCARE KGAA (DE) 2024-01-25 US disclosed
US-20240025922-A1 TETRAHYDROPYRIDO[3,4-d]PYRIMIDINES AS HPK1 INHIBITORS MERCK HEALTHCARE KGAA (DE) 2024-01-25 US disclosed
WO-2023220541-A1 TETRAHYDROPYRIDO[3,4-D]PYRIMIDINES COMPOUNDS AS HPK1 INHIBITORS MERCK PATENT GMBH (DE) 2023-11-16 WO 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-20240025922-A1 TETRAHYDROPYRIDO[3,4-d]PYRIMIDINES AS HPK1 INHIBITORS PDXK, DTYMK, HIPK1 NR1H2 2066/4885PIK3R1 2885/4885PIK3CA 390/4885

“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.