SCHEMBL31423946

SCHEMBL31423946

CC(C)Oc1c(-c2cn[nH]c2)c(F)cn2nc(N[C@@H](C)CF)nc12

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.33
JAK3 P52333 1/20 0.33
PTK2 Q05397 1/20 0.33
NTRK1 P04629 1/20 0.33
MAPK8 P45983 1/20 0.31
ADORA2A P29274 2/20 0.31
ADORA2B P29275 2/20 0.31
ADORA1 P30542 2/20 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
SCHEMBL31423965 0.82 MAPK8 (0.33) JAK2JAK3PTK2MAPK8ADORA2A
SCHEMBL31423968 0.82 JAK2 (0.35) JAK2JAK3
SCHEMBL31423901 0.74 MAPK8 (0.32) JAK2JAK3PTK2MAPK8
SCHEMBL31423988 0.74 MAPK8 (0.32) JAK2JAK3PTK2MAPK8
SCHEMBL31423908 0.74 MAPK8 (0.32) JAK2JAK3PTK2MAPK8
SCHEMBL31423976 0.74 MAPK8 (0.32) JAK2JAK3PTK2MAPK8
SCHEMBL31423920 0.73 ATR (0.33) JAK2JAK3PTK2MAPK8
SCHEMBL31423981 0.72 MAPK8 (0.31) MAPK8
SCHEMBL31423962 0.70 MAPK8 (0.33) JAK2JAK3PTK2MAPK8
SCHEMBL31423883 0.70 MAPK8 (0.33) JAK2JAK3PTK2MAPK8

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