SCHEMBL25518161

SCHEMBL25518161

Cn1cc(-c2ncnc3[nH]cc(-c4ccc5nccn5c4)c23)cn1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 13/20 0.51
▸ ROCK2 O75116 4/20 0.45
▸ ROCK1 Q13464 4/20 0.45
▸ CDC42BPB Q9Y5S2 4/20 0.45
▸ TGFBR1 P36897 1/20 0.40
▸ CDC42BPA Q5VT25 3/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ JAK3 P52333 1/20 0.39

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
SCHEMBL30347318 1.00 LRRK2 (0.51) LRRK2ROCK2ROCK1CDC42BPBTGFBR1
SCHEMBL26174620 0.85 ROCK2 (0.54) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL25198211 0.84 LRRK2 (0.55) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30346816 0.84 LRRK2 (0.55) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30347624 0.83 LRRK2 (0.53) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL25518654 0.83 LRRK2 (0.53) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30348542 0.82 LRRK2 (0.47) LRRK2ROCK2ROCK1CDC42BPBMAPK1
SCHEMBL25197327 0.82 LRRK2 (0.47) LRRK2ROCK2ROCK1CDC42BPBMAPK1
SCHEMBL25156870 0.81 LRRK2 (0.48) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30348428 0.81 LRRK2 (0.48) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2023-06-01 — — US disclosed
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 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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF DYRK1A, DYRK1B, DYRK2 LRRK2 729/4885ROCK2 998/4885ROCK1 788/4885

“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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