SCHEMBL31458726

SCHEMBL31458726

CCOC(C)n1cc(-c2ncn3ncnc3c2OC)cn1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.43
JAK1 P23458 2/20 0.43
TYK2 P29597 2/20 0.43
JAK3 P52333 2/20 0.43
MAP3K5 Q99683 2/20 0.35
CD274 Q9NZQ7 1/20 0.34
SIGMAR1 Q99720 1/20 0.32
BRD4 O60885 1/20 0.31

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
SCHEMBL31458743 0.85 JAK2 (0.44) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL25226197 0.83 JAK2 (0.43) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL25220733 0.83 JAK2 (0.43) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL31423892 0.78 JAK2 (0.43) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL31423994 0.78 JAK2 (0.39) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL25673249 0.74 JAK2 (0.38) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL23209287 0.74 JAK2 (0.42) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL23209255 0.74 JAK2 (0.42) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL12066113 0.73 JAK2 (0.54) JAK2JAK1TYK2JAK3MAP3K5
SCHEMBL23209356 0.71 JAK2 (0.43) JAK2JAK1TYK2JAK3MAP3K5

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
WO-2025096061-A1 CDK2 INHIBITORS AND USES THEREOF ODYSSEY THERAPEUTICS, INC. (US) 2025-05-08 WO disclosed