SCHEMBL26457407

SCHEMBL26457407

C(=C1C2CCCC1C2)c1ccc2nccnc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ CLK1 P49759 2/20 0.44
▸ DYRK1A Q13627 2/20 0.44
▸ DYRK2 Q92630 2/20 0.44
▸ DYRK1B Q9Y463 2/20 0.44
▸ PIK3CD O00329 1/20 0.44
▸ CSNK2A2 P19784 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ PIK3CA P42336 1/20 0.44
▸ PIK3CB P42338 1/20 0.44
▸ MTOR P42345 1/20 0.44
▸ PIK3CG P48736 1/20 0.44
▸ CSNK2B P67870 1/20 0.44
▸ CSNK2A1 P68400 1/20 0.44
▸ CISD1 Q9NZ45 1/20 0.44
▸ CHRNB4 P30926 3/20 0.37
▸ CHRNA3 P32297 3/20 0.37
▸ CHRNB2 P17787 2/20 0.37
▸ CHRNA4 P43681 2/20 0.37

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
SCHEMBL23987071 0.77 DYRK1A (0.51) CLK1DYRK1ADYRK2DYRK1BPIK3CD
SCHEMBL26493523 0.76 EGFR (0.42) PIK3CDPIK3CA
SCHEMBL26457447 0.72 TRPM5 (0.35) NPC1RAB9APOLBMAPTCYP3A4
SCHEMBL26493498 0.72 CCNE1 (0.40) CYP3A4
SCHEMBL23987063 0.72 CLK1 (0.49) NPC1RAB9ACLK1DYRK1ADYRK2
SCHEMBL2616761 0.70 CHRNB2 (0.62) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA1
SCHEMBL13561408 0.70 CHRNB2 (0.62) CHRNB4CHRNA3CHRNB2CHRNA4CHRNA1
SCHEMBL26463977 0.69 — —
SCHEMBL3274768 0.68 NPC1 (0.45) NPC1RAB9ACLK1DYRK1ADYRK2
SCHEMBL97820 0.68 RAB9A (0.49) NPC1RAB9ACLK1DYRK1ADYRK2

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
WO-2023072969-A1 IMIDAZOLONE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES IN PARTICULAR DYRK1A, CLK1 AND/OR CLK4 PERHA PHARMACEUTICALS (FR) 2023-05-04 — — WO disclosed
EP-4173674-A1 IMIDAZOLONE DERIVATIVES AS INHIBITORS OF PROTEIN KINASES IN PARTICULAR DYRK1A, CLK1 AND/OR CLK4 Perha Pharmaceuticals (FR) 2023-05-03 — — EP disclosed
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