SCHEMBL25196460

SCHEMBL25196460

Cn1cc(-c2ncnc3[nH]cc(-c4ccn5ncc(-c6cnn(C)c6)c5c4)c23)cn1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 14/20 0.53
▸ ROCK2 O75116 2/20 0.44
▸ ROCK1 Q13464 2/20 0.44
▸ CDC42BPB Q9Y5S2 2/20 0.44
▸ PIK3CD O00329 1/20 0.41
▸ PIK3R1 P27986 1/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ PIK3CB P42338 1/20 0.41
▸ PIK3CG P48736 1/20 0.41
▸ JAK3 P52333 2/20 0.39
▸ CDC42BPA Q5VT25 1/20 0.39
▸ MAPK1 P28482 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
SCHEMBL30346680 1.00 LRRK2 (0.53) LRRK2ROCK2ROCK1CDC42BPBPIK3CD
SCHEMBL26174631 0.85 ROCK2 (0.53) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30398344 0.85 ROCK2 (0.53) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30349042 0.84 LRRK2 (0.52) LRRK2ROCK2ROCK1CDC42BPBPIK3CD
SCHEMBL30346595 0.82 ALK (0.43) LRRK2MAPK1
SCHEMBL25157820 0.82 ALK (0.43) LRRK2MAPK1
SCHEMBL25209102 0.82 JAK3 (0.43) LRRK2ROCK2ROCK1CDC42BPBJAK3
SCHEMBL30348403 0.82 JAK3 (0.43) LRRK2ROCK2ROCK1CDC42BPBJAK3
SCHEMBL30399086 0.81 PRKCA (0.50) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26174595 0.81 PRKCA (0.50) 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 3 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 claimed
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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