SCHEMBL30348906

SCHEMBL30348906

Cn1cc(-c2ncnc3[nH]cc(-c4ccc5nnn(C)c5c4)c23)cn1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 13/20 0.49
▸ JAK3 P52333 2/20 0.42
▸ ROCK2 O75116 2/20 0.41
▸ ROCK1 Q13464 2/20 0.41
▸ CDC42BPB Q9Y5S2 2/20 0.41
▸ TDO2 P48775 1/20 0.38
▸ KIT P10721 1/20 0.37
▸ CDC42BPA Q5VT25 1/20 0.36

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
SCHEMBL25200736 1.00 LRRK2 (0.49) LRRK2JAK3ROCK2ROCK1CDC42BPB
SCHEMBL30347892 0.89 LRRK2 (0.46) LRRK2JAK3ROCK2ROCK1CDC42BPB
SCHEMBL25204231 0.89 LRRK2 (0.46) LRRK2JAK3ROCK2ROCK1CDC42BPB
SCHEMBL30400624 0.85 ROCK2 (0.52) LRRK2ROCK2ROCK1CDC42BPBTDO2
SCHEMBL26174628 0.85 ROCK2 (0.52) LRRK2ROCK2ROCK1CDC42BPBTDO2
SCHEMBL25203990 0.83 LRRK2 (0.53) LRRK2JAK3ROCK2ROCK1CDC42BPB
SCHEMBL25158143 0.81 LRRK2 (0.50) LRRK2JAK3ROCK2ROCK1CDC42BPB
SCHEMBL30349516 0.80 EGFR (0.50) LRRK2JAK3ROCK2ROCK1CDC42BPB
SCHEMBL25201354 0.80 EGFR (0.50) LRRK2JAK3ROCK2ROCK1CDC42BPB
SCHEMBL30400374 0.80 ALK (0.55) —

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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