SCHEMBL30346816

SCHEMBL30346816

Cn1cc(-c2ncnc3[nH]cc(-c4cnc5nccn5c4)c23)cn1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 13/20 0.55
▸ ROCK2 O75116 5/20 0.46
▸ ROCK1 Q13464 5/20 0.46
▸ CDC42BPB Q9Y5S2 5/20 0.46
▸ CDC42BPA Q5VT25 3/20 0.40
▸ JAK3 P52333 1/20 0.40
▸ MAPK1 P28482 1/20 0.40

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
SCHEMBL25198211 1.00 LRRK2 (0.55) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26174621 0.85 ROCK2 (0.55) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30347318 0.84 LRRK2 (0.51) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL25518161 0.84 LRRK2 (0.51) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL30348428 0.82 LRRK2 (0.48) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL25156870 0.82 LRRK2 (0.48) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL26175335 0.78 ALK (0.58) —
SCHEMBL26176230 0.76 MAPT (0.47) LRRK2ROCK2ROCK1CDC42BPBMAPK1
SCHEMBL25203990 0.75 LRRK2 (0.53) LRRK2ROCK2ROCK1CDC42BPBCDC42BPA
SCHEMBL25196460 0.75 LRRK2 (0.53) 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
EP-4415818-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AS DYRK1A INHIBITORS BioSplice Therapeutics, Inc. (US) 2024-08-21 — — EP claimed
WO-2023064361-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AS DYRK1A INHIBITORS BIOSPLICE THERAPEUTICS, INC. (US) 2023-04-20 — — WO claimed
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