SCHEMBL25646429

SCHEMBL25646429

Cn1cc(-c2ccc3cnc(-c4cnn(C)c4)cc3c2)cn1

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 19/20 0.57
▸ DYRK1A Q13627 19/20 0.57
▸ WNT1 P04628 14/20 0.57
▸ CLK2 P49760 1/20 0.54
▸ CLK3 P49761 1/20 0.54
▸ ABL1 P00519 1/20 0.51

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
SCHEMBL19662951 0.84 PIM1 (0.53) —
SCHEMBL25603068 0.83 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL20945222 0.83 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL15507418 0.83 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL30481240 0.83 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL30381685 0.83 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23762167 0.82 CYP11B1 (0.47) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL23048755 0.82 DYRK1A (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL19546567 0.81 GSK3B (0.67) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL25646448 0.81 GSK3B (0.54) GSK3BDYRK1AWNT1CLK2CLK3

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
WO-2023107722-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2023-06-15 — — WO disclosed
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