SCHEMBL27762575

SCHEMBL27762575

CC(C(F)C#N)n1ccc(-c2ncnc3[nH]ccc23)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 17/20 0.44
▸ JAK1 P23458 13/20 0.44
▸ JAK3 P52333 8/20 0.44
▸ TYK2 P29597 5/20 0.44
▸ AXL P30530 1/20 0.43
▸ MERTK Q12866 1/20 0.43
▸ RET P07949 4/20 0.43
▸ ROCK1 Q13464 4/20 0.43
▸ DAPK3 O43293 3/20 0.43
▸ PAK4 O96013 3/20 0.43
▸ LTK P29376 3/20 0.43
▸ CSNK1A1 P48729 3/20 0.43
▸ CLK2 P49760 3/20 0.43
▸ TNK2 Q07912 3/20 0.43
▸ DYRK1A Q13627 3/20 0.43
▸ IKBKE Q14164 3/20 0.43
▸ NTRK3 Q16288 3/20 0.43
▸ LRRK2 Q5S007 3/20 0.43
▸ CAMK1D Q8IU85 3/20 0.43
▸ CLK4 Q9HAZ1 3/20 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
SCHEMBL27868344 0.86 JAK2 (0.48) JAK2JAK1JAK3TYK2AXL
SCHEMBL27741971 0.81 JAK2 (0.59) JAK2JAK1JAK3TYK2AXL
SCHEMBL101810 0.81 JAK2 (0.53) JAK2JAK1JAK3TYK2AXL
SCHEMBL17227592 0.77 JAK2 (0.49) JAK2JAK1JAK3TYK2AXL
SCHEMBL101138 0.76 AXL (0.49) JAK2JAK1JAK3TYK2AXL
SCHEMBL21316579 0.76 AXL (0.49) JAK2JAK1JAK3TYK2AXL
SCHEMBL171699 0.76 AXL (0.49) JAK2JAK1JAK3TYK2AXL
SCHEMBL12506701 0.74 AXL (0.48) JAK2JAK1JAK3TYK2AXL
SCHEMBL22930855 0.73 JAK2 (0.58) JAK2JAK1JAK3TYK2RET
SCHEMBL12250906 0.72 JAK2 (0.61) JAK2JAK1JAK3TYK2AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103254190-A Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as janus kinase inhibitors INCYTE CORP 2013-08-21 — — CN disclosed
CN-101448826-A Heteroaryl substituted pyrrolo [2 ] as janus kinase inhibitors INCYTE CORP (US) 2009-06-03 — — CN disclosed
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