SCHEMBL25215177

SCHEMBL25215177

Cn1cc(-c2ncnc3[nH]cc(-c4cccs4)c23)cn1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ STK4 Q13043 1/20 0.54
▸ STK3 Q13188 1/20 0.54
▸ LRRK2 Q5S007 12/20 0.52
▸ JAK2 O60674 3/20 0.45
▸ JAK1 P23458 2/20 0.45
▸ FYN P06241 1/20 0.43
▸ GRK5 P34947 1/20 0.43
▸ ROCK2 O75116 1/20 0.43
▸ ROCK1 Q13464 1/20 0.43
▸ CDC42BPB Q9Y5S2 1/20 0.43
▸ CDK8 P49336 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ JAK3 P52333 1/20 0.41

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
SCHEMBL30348045 0.77 LRRK2 (0.45) LRRK2ROCK2ROCK1CDC42BPBMAPK1
SCHEMBL25518134 0.77 LRRK2 (0.45) LRRK2ROCK2ROCK1CDC42BPBMAPK1
SCHEMBL13695778 0.76 LRRK2 (0.55) LRRK2ROCK2ROCK1CDC42BPB
SCHEMBL25518654 0.75 LRRK2 (0.53) LRRK2ROCK2ROCK1CDC42BPBMAPK1
SCHEMBL30347624 0.75 LRRK2 (0.53) LRRK2ROCK2ROCK1CDC42BPBMAPK1
SCHEMBL25203990 0.75 LRRK2 (0.53) LRRK2JAK2ROCK2ROCK1CDC42BPB
SCHEMBL30349042 0.74 LRRK2 (0.52) STK4STK3LRRK2ROCK2ROCK1
SCHEMBL25201354 0.74 EGFR (0.50) LRRK2ROCK2ROCK1CDC42BPBJAK3
SCHEMBL30348906 0.74 LRRK2 (0.49) LRRK2ROCK2ROCK1CDC42BPBJAK3
SCHEMBL25200736 0.74 LRRK2 (0.49) LRRK2ROCK2ROCK1CDC42BPBJAK3

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2023-06-01 — — US claimed

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF DYRK1A, DYRK1B, DYRK2 STK4 689/4885STK3 471/4885LRRK2 729/4885

“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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