SCHEMBL17685337

SCHEMBL17685337

CC(C)(C)OC(=O)N1C(=O)C(C)(C)c2ccc(Nc3nc4cccc(C(O)C5CCOCC5)n4n3)cc21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 15/20 0.42
JAK3 P52333 14/20 0.42
PTK2 Q05397 13/20 0.39
EGFR P00533 1/20 0.32
BTK Q06187 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
MAPT P10636 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
JAK1 P23458 1/20 0.32

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
SCHEMBL3303800 0.91 JAK2 (0.36) JAK2JAK3PTK2JAK1
SCHEMBL3303111 0.88 JAK2 (0.35) JAK2JAK3PTK2EGFRBTK
SCHEMBL17685383 0.86 JAK2 (0.43) JAK2JAK3PTK2JAK1
SCHEMBL17685269 0.86 JAK2 (0.41) JAK2JAK3PTK2JAK1
SCHEMBL17685344 0.84 JAK2 (0.40) JAK2JAK3PTK2EGFRBTK
SCHEMBL3303842 0.81 JAK2 (0.37) JAK2JAK3PTK2
SCHEMBL3301011 0.81 JAK2 (0.36) JAK2JAK3PTK2JAK1
SCHEMBL2144689 0.80 JAK2 (0.42) JAK2JAK3PTK2JAK1
SCHEMBL2144686 0.80 JAK2 (0.42) JAK2JAK3PTK2JAK1
SCHEMBL3306749 0.80 JAK3 (0.35) JAK2JAK3PTK2EGFRBTK

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-2344494-B1 AMINOTRIAZOLOPYRIDINES AND THEIR USE AS KINASE INHIBITORS SIGNAL PHARM LLC (US) 2016-04-20 EP disclosed