SCHEMBL26640962

SCHEMBL26640962

c1cc(Nc2ncc3c(n2)CNCC3)ccc1CN1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.50
AURKB Q96GD4 1/20 0.50
EGFR P00533 4/20 0.48
IGF1R P08069 1/20 0.48
STAT6 P42226 1/20 0.47
PLK4 O00444 1/20 0.47
MAPT P10636 5/20 0.47
TP53 P04637 2/20 0.47
JAK2 O60674 2/20 0.46
CDK2 P24941 2/20 0.46
JAK3 P52333 2/20 0.45
CCNA2 P20248 1/20 0.45
CCNA1 P78396 1/20 0.45
GRM5 P41594 1/20 0.45
PTK2 Q05397 1/20 0.43

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
SCHEMBL26640771 0.90 GRM5 (0.50) PLK4MAPTTP53JAK2CDK2
SCHEMBL26640349 0.88 AXL (0.51) AURKAAURKBIGF1RMAPTTP53
SCHEMBL30648664 0.88 CDK1 (0.54) AURKAIGF1RPLK4MAPTJAK2
SCHEMBL26640314 0.88 CDK1 (0.54) AURKAIGF1RPLK4MAPTJAK2
SCHEMBL26639995 0.84 AXL (0.51) AURKAAURKBEGFRIGF1RJAK2
SCHEMBL26640487 0.82 MAPT (0.46) AURKAMAPTTP53CDK2CCNA2
SCHEMBL30648787 0.82 STAT6 (0.42) IGF1RSTAT6MAPTTP53CDK2
SCHEMBL26640963 0.82 STAT6 (0.42) IGF1RSTAT6MAPTTP53CDK2
SCHEMBL26640878 0.82 GRM5 (0.47) STAT6MAPTTP53CDK2CCNA2
SCHEMBL27054171 0.80 CDK5 (0.49) MAPTTP53CDK2JAK3CCNA2

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 AURKA 483/4885AURKB 437/4885EGFR 3823/4885

“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.