SCHEMBL31423944

SCHEMBL31423944

CCOC(C)n1cc(-c2ccc3nc(NC4CCOCC4)nn3c2OCC(F)(F)F)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 1/20 0.36
JAK2 O60674 3/20 0.34
JAK1 P23458 3/20 0.34
TYK2 P29597 3/20 0.34
JAK3 P52333 3/20 0.34
IRAK1 P51617 2/20 0.34
PIM1 P11309 2/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MAPK8 P45983 1/20 0.33
MAPK9 P45984 1/20 0.33
MAPK10 P53779 1/20 0.33
CCNE1 P24864 2/20 0.32
CDK2 P24941 2/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
IDH2 P48735 1/20 0.32
TTK P33981 1/20 0.32
PDE1B Q01064 1/20 0.32
PDE1C Q14123 1/20 0.32
LRRK2 Q5S007 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
SCHEMBL31423919 0.85 CD274 (0.40) CD274JAK2JAK1TYK2JAK3
SCHEMBL31423896 0.81 PIM1 (0.40) JAK1PIM1MKNK1CCNE1CDK2
SCHEMBL31423880 0.80 JAK2 (0.39) CD274JAK2JAK1TYK2JAK3
SCHEMBL31424012 0.80 JAK2 (0.36) CD274JAK2JAK1TYK2JAK3
SCHEMBL31458674 0.78 JAK2 (0.34) CD274JAK2JAK1TYK2JAK3
SCHEMBL31423973 0.75 CD274 (0.35) CD274JAK2JAK1TYK2JAK3
SCHEMBL25227147 0.73 CD274 (0.39) CD274JAK2JAK1TYK2JAK3
SCHEMBL31423890 0.72 JAK2 (0.36) CD274JAK2JAK1TYK2JAK3
SCHEMBL31318302 0.72 CD274 (0.38) CD274JAK2JAK1TYK2JAK3
SCHEMBL31318303 0.72 CD274 (0.38) CD274JAK2JAK1TYK2JAK3

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-2025054386-A1 CDK2 INHIBITORS AND USES THEREOF ODYSSEY THERAPEUTICS, INC. (US) 2025-03-13 WO disclosed