SCHEMBL26397024

SCHEMBL26397024

N#Cc1ccc(Cl)c(-c2ccc3[nH]nc(NC=O)c3c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 4/20 0.41
▸ JAK3 P52333 2/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ JAK1 P23458 1/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ CDC7 O00311 3/20 0.39
▸ DAPK3 O43293 2/20 0.39
▸ ROCK2 O75116 2/20 0.39
▸ PAK4 O96013 2/20 0.39
▸ CDK2 P24941 2/20 0.39
▸ FLT3 P36888 2/20 0.39
▸ CSNK1A1 P48729 2/20 0.39
▸ CDK8 P49336 2/20 0.39
▸ CLK2 P49760 2/20 0.39
▸ CDK7 P50613 2/20 0.39
▸ CDK9 P50750 2/20 0.39
▸ PRKX P51817 2/20 0.39
▸ CDK5 Q00535 2/20 0.39
▸ DYRK1A Q13627 2/20 0.39
▸ MELK Q14680 2/20 0.39

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
SCHEMBL26393678 0.86 LRRK2 (0.41) LRRK2JAK3CDC7DAPK3ROCK2
SCHEMBL26396309 0.86 LRRK2 (0.45) LRRK2JAK3JAK2JAK1TYK2
SCHEMBL26394024 0.84 GSK3B (0.44) LRRK2JAK3JAK2JAK1TYK2
SCHEMBL26393862 0.84 GSK3B (0.45) JAK3JAK2JAK1TYK2DAPK3
SCHEMBL26396791 0.84 GSK3B (0.47) LRRK2JAK3JAK2TYK2CDC7
SCHEMBL26393947 0.82 JAK2 (0.61) JAK3JAK2JAK1TYK2DAPK3
SCHEMBL26393960 0.81 JAK2 (0.40) JAK3JAK2JAK1TYK2DAPK3
SCHEMBL26394010 0.81 JAK2 (0.40) JAK3JAK2JAK1TYK2DAPK3
SCHEMBL26393577 0.81 FADS1 (0.47) JAK3JAK2JAK1TYK2CDC7
SCHEMBL26393501 0.79 JAK2 (0.44) JAK3JAK2JAK1TYK2HDAC6

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-2023186773-A1 SUBSTITUTED 3-AMINO INDAZOLE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2023-10-05 — — WO disclosed
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