SCHEMBL28832599

SCHEMBL28832599

N#CCNC(=O)c1ccc(-c2ccnc(Nc3ccc(N4CCC(N5CCCC5=O)CC4)cc3)c2)cc1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 20/20 0.76
▸ JAK1 P23458 17/20 0.76
▸ JAK3 P52333 17/20 0.76
▸ HDAC1 Q13547 2/20 0.52

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
SCHEMBL16445831 0.86 JAK2 (1.00) JAK2JAK1JAK3HDAC1
SCHEMBL30051820 0.82 JAK2 (0.71) JAK2JAK1JAK3HDAC1
SCHEMBL2866288 0.82 JAK2 (0.71) JAK2JAK1JAK3HDAC1
SCHEMBL16446258 0.82 JAK2 (1.00) JAK2JAK1JAK3
SCHEMBL16446232 0.81 JAK2 (0.85) JAK2JAK1JAK3
SCHEMBL16446317 0.81 JAK2 (0.85) JAK2JAK1JAK3
SCHEMBL16446248 0.76 JAK2 (0.82) JAK2JAK1JAK3HDAC1
SCHEMBL16446822 0.74 JAK2 (1.00) JAK2JAK1JAK3HDAC1
SCHEMBL16446777 0.73 JAK2 (1.00) JAK2JAK1JAK3HDAC1
SCHEMBL16446784 0.72 JAK2 (0.81) JAK2JAK1JAK3HDAC1

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
CN-105837927-A Preparation method of halogen-free flame-retardant polyolefin power cable 扬州兰都塑料科技有限公司 2016-08-10 — — CN disclosed
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