SCHEMBL26813328

SCHEMBL26813328

CC(C)(C)OC(=O)N1CCc2cnc(Nc3ccc(C[S+]=O)c(F)c3)nc2C1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.59
▸ MAPK1 P28482 15/20 0.49
▸ PDGFRB P09619 1/20 0.44
▸ IGF1R P08069 1/20 0.44
▸ DDB1 Q16531 1/20 0.43
▸ CRBN Q96SW2 1/20 0.43
▸ CDK2 P24941 3/20 0.42
▸ JAK2 O60674 1/20 0.42
▸ JAK3 P52333 1/20 0.42
▸ PTK2 Q05397 1/20 0.42

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
SCHEMBL30648754 0.89 MAPT (0.55) MAPTMAPK1PDGFRBIGF1RDDB1
SCHEMBL26640372 0.89 MAPT (0.55) MAPTMAPK1PDGFRBIGF1RDDB1
SCHEMBL26640018 0.84 MAPT (0.57) MAPTMAPK1PDGFRBDDB1CRBN
SCHEMBL30648629 0.84 MAPT (0.57) MAPTMAPK1PDGFRBDDB1CRBN
SCHEMBL26640202 0.82 MAPT (0.62) MAPTMAPK1PDGFRBIGF1RDDB1
SCHEMBL26640194 0.81 MAPT (0.56) MAPTMAPK1PDGFRBIGF1RDDB1
SCHEMBL26640500 0.81 MAPT (0.56) MAPTMAPK1PDGFRBIGF1RDDB1
SCHEMBL26640456 0.81 MAPT (0.64) MAPTMAPK1PDGFRBIGF1RDDB1
SCHEMBL26640688 0.81 MAPT (0.66) MAPTMAPK1PDGFRBDDB1CRBN
SCHEMBL30648622 0.80 MAPT (0.61) MAPTMAPK1PDGFRBIGF1RDDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAPT 3283/4885MAPK1 404/4885PDGFRB 2786/4885

“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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