SCHEMBL4560798

SCHEMBL4560798

CCNC(=O)Cn1cc(Nc2ncc(C)c(-c3ccc(C(C)C)cc3)n2)cn1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 11/20 0.48
▸ JAK2 O60674 15/20 0.47
▸ JAK1 P23458 11/20 0.47
▸ FLT3 P36888 8/20 0.47
▸ TYK2 P29597 7/20 0.47
▸ STAT3 P40763 2/20 0.43

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
SCHEMBL4562646 0.89 JAK2 (0.48) JAK3JAK2JAK1FLT3TYK2
SCHEMBL4561138 0.88 JAK2 (0.49) JAK3JAK2JAK1FLT3TYK2
SCHEMBL4559060 0.87 JAK2 (0.44) JAK3JAK2JAK1FLT3TYK2
SCHEMBL4559528 0.86 CDK1 (0.43) JAK3JAK2JAK1FLT3TYK2
SCHEMBL27935904 0.86 JAK2 (0.43) JAK3JAK2JAK1FLT3TYK2
SCHEMBL4561601 0.83 JAK3 (0.42) JAK3JAK2JAK1FLT3TYK2
SCHEMBL4562156 0.82 JAK1 (0.42) JAK3JAK2JAK1FLT3TYK2
SCHEMBL4561201 0.81 KDM4E (0.43) JAK3JAK2JAK1FLT3TYK2
SCHEMBL4561908 0.81 JAK1 (0.43) JAK3JAK2JAK1FLT3TYK2
SCHEMBL4560697 0.80 JAK2 (0.47) JAK3JAK2JAK1FLT3TYK2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2638018-A1 PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS Cellzome Limited (GB) 2013-09-18 — — EP claimed
CN-103298794-A Pyridine compounds and aza analogues thereof as TYK2 inhibitors CELLZOME LTD 2013-09-11 — — CN claimed
WO-2012062704-A1 PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS CELLZOME LIMITED (GB) 2012-05-18 — — WO claimed
EP-2638018-A1 PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS Cellzome Limited (GB) 2013-09-18 — — EP disclosed
CN-103298794-A Pyridine compounds and aza analogues thereof as TYK2 inhibitors CELLZOME LTD 2013-09-11 — — CN disclosed
WO-2012062704-A1 PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS CELLZOME LIMITED (GB) 2012-05-18 — — WO disclosed
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