SCHEMBL26394284

SCHEMBL26394284

CNc1n[nH]c2ccc(-c3c(F)ccc(C)c3Cl)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK8 P49336 3/20 0.46
▸ CCNC P24863 2/20 0.46
▸ FADS1 O60427 4/20 0.39
▸ JAK2 O60674 3/20 0.39
▸ TRPA1 O75762 2/20 0.38
▸ GSK3B P49841 3/20 0.38
▸ FLT4 P35916 2/20 0.38
▸ PLK4 O00444 1/20 0.38
▸ MAPK13 O15264 1/20 0.38
▸ DAPK3 O43293 1/20 0.38
▸ PRKD3 O94806 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ CDK1 P06493 1/20 0.38
▸ PIM1 P11309 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ MARK3 P27448 1/20 0.38
▸ MAPK8 P45983 1/20 0.38
▸ MAPK9 P45984 1/20 0.38
▸ CLK2 P49760 1/20 0.38
▸ MAPK12 P53778 1/20 0.38

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
SCHEMBL26396737 0.81 PIM1 (0.45) CDK8CCNCFADS1JAK2GSK3B
SCHEMBL26394288 0.77 GSK3B (0.50) GSK3BPIM1CDK2DYRK1AGSK3A
SCHEMBL26394241 0.77 HDAC6 (0.48) CDK8CCNCFADS1JAK2GSK3B
SCHEMBL26395345 0.76 LRRK2 (0.42) CDK8CCNCTRPA1GSK3BFLT4
SCHEMBL26395413 0.74 DYRK1A (0.43) CDK8CCNCJAK2GSK3BFLT4
SCHEMBL5773496 0.74 FADS1 (0.60) CDK8CCNCFADS1TRPA1GSK3B
SCHEMBL26395290 0.73 NMT1 (0.50) CDK8CCNCFADS1GSK3BFLT4
SCHEMBL26394484 0.73 JAK2 (0.49) CDK8CCNCFADS1JAK2TRPA1
Hydrochloric Acid SCHEMBL28378770 0.72 FADS1 (0.59) CDK8CCNCFADS1TRPA1GSK3B
SCHEMBL26393486 0.72 HDAC6 (0.50) CDK8CCNCFADS1JAK2TRPA1

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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