SCHEMBL17827138

SCHEMBL17827138

NO/N=C(\c1c(Cl)cnc2[nH]ccc12)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 11/20 0.44
▸ AURKA O14965 3/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ JAK1 P23458 10/20 0.38
▸ JAK2 O60674 8/20 0.38
▸ PRKCA P17252 2/20 0.38
▸ KDR P35968 2/20 0.38
▸ HPGDS O60760 1/20 0.36
▸ PBK Q96KB5 1/20 0.36

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
SCHEMBL1536810 0.87 JAK3 (0.46) JAK3AURKATYK2JAK1JAK2
SCHEMBL13579878 0.87 JAK3 (0.46) JAK3AURKATYK2JAK1JAK2
SCHEMBL1536809 0.87 JAK3 (0.46) JAK3AURKATYK2JAK1JAK2
SCHEMBL1536881 0.86 JAK3 (0.44) JAK3AURKATYK2JAK1JAK2
SCHEMBL1536883 0.86 JAK3 (0.44) JAK3AURKATYK2JAK1JAK2
SCHEMBL13579882 0.86 JAK3 (0.44) JAK3AURKATYK2JAK1JAK2
SCHEMBL13579883 0.84 JAK3 (0.43) JAK3AURKATYK2JAK1JAK2
SCHEMBL1536865 0.84 JAK3 (0.43) JAK3AURKATYK2JAK1JAK2
SCHEMBL1536864 0.84 JAK3 (0.43) JAK3AURKATYK2JAK1JAK2
SCHEMBL13579884 0.83 JAK3 (0.41) JAK3AURKATYK2JAK1JAK2

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
EP-3031324-A2 TRICYCLIC KINASE INHIBITORS AbbVie Inc. (US) 2016-06-15 — — EP disclosed
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