SCHEMBL30381685

SCHEMBL30381685

Cn1cc(-c2ccc3cnc(N)cc3c2)cn1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 16/20 0.56
▸ DYRK1A Q13627 16/20 0.56
▸ WNT1 P04628 11/20 0.56
▸ CLK2 P49760 1/20 0.53
▸ CLK3 P49761 1/20 0.53
▸ PIK3CD O00329 1/20 0.51
▸ PIK3CA P42336 1/20 0.51
▸ PIK3CB P42338 1/20 0.51
▸ PI4KA P42356 1/20 0.51
▸ PIK3CG P48736 1/20 0.51
▸ PI4KB Q9UBF8 1/20 0.51
▸ TTK P33981 2/20 0.50
▸ ABL1 P00519 1/20 0.50

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
SCHEMBL20945222 1.00 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL25424298 0.94 ABL1 (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL30695432 0.90 GSK3B (0.47) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL20916079 0.87 GSK3B (0.50) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL10165956 0.85 PDPK1 (0.43) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL25646429 0.83 GSK3B (0.57) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL15507418 0.82 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL30481240 0.82 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL25603068 0.82 GSK3B (0.56) GSK3BDYRK1AWNT1CLK2CLK3
SCHEMBL30695495 0.80 PIK3CD (0.55) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118843626-A Heterocyclic compounds as DYRK1A inhibitors 普罗塞纳生物科学有限公司 2024-10-25 — — CN disclosed
EP-4444420-A2 CYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Prothena Biosciences Limited (IE) 2024-10-16 — — EP disclosed
CN-117209469-A Compounds as CLK inhibitors and uses thereof 南京圣和药物研发有限公司 2023-12-12 — — CN disclosed
WO-2023107723-A2 METHODS FOR TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2023-06-15 — — WO disclosed
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