SCHEMBL26457447

SCHEMBL26457447

C(=C1C2CCCC1C2)c1ccc2ncccc2n1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRPM5 Q9NZQ8 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CCNE1 P24864 3/20 0.32
▸ CDK2 P24941 3/20 0.32
▸ CDK5 Q00535 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ PDE10A Q9Y233 1/20 0.30

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
SCHEMBL26457407 0.72 NPC1 (0.44) CYP3A4KDM4ENPC1RAB9AMAPT
SCHEMBL1224754 0.71 ALDH1A1 (0.56) TRPM5ALDH1A1CYP3A4KDM4ENPC1
SCHEMBL27794596 0.71 ALDH1A1 (0.56) TRPM5ALDH1A1CYP3A4KDM4ENPC1
SCHEMBL27917394 0.68 ALDH1A1 (0.45) TRPM5ALDH1A1CYP3A4KDM4ENPC1
SCHEMBL899929 0.68 ALDH1A1 (0.45) TRPM5ALDH1A1CYP3A4KDM4ENPC1
SCHEMBL902793 0.66 ALDH1A1 (0.43) ALDH1A1CYP3A4KDM4ENPC1RAB9A
SCHEMBL10025840 0.65 CHRNB4 (0.42) ALDH1A1CCNE1CDK2CDK5KDM4E
SCHEMBL5570154 0.65 PIM1 (0.40) TRPM5ALDH1A1CYP3A4KDM4ENPC1
SCHEMBL29027447 0.64 ALDH1A1 (0.41) TRPM5ALDH1A1CYP3A4KDM4ENPC1
SCHEMBL30099834 0.61 ALDH1A1 (0.67) ALDH1A1CYP3A4KDM4ENPC1RAB9A

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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