SCHEMBL24243285

SCHEMBL24243285

Cc1nc(Nc2cnn(CCN3CCOCC3)c2)nc2[nH]ccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 9/20 0.58
BTK Q06187 7/20 0.58
TTK P33981 2/20 0.50
PTK2 Q05397 5/20 0.49
JAK2 O60674 3/20 0.43
TBK1 Q9UHD2 3/20 0.43
LRRK2 Q5S007 3/20 0.43
IKBKE Q14164 2/20 0.43
CHEK1 O14757 2/20 0.43
AURKA O14965 2/20 0.43
MAP4K4 O95819 2/20 0.43
PAK4 O96013 2/20 0.43
ABL1 P00519 2/20 0.43
CSF1R P07333 2/20 0.43
RET P07949 2/20 0.43
LTK P29376 2/20 0.43
KDR P35968 2/20 0.43
MAPK8 P45983 2/20 0.43
MAPK9 P45984 2/20 0.43
RPS6KA3 P51812 2/20 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
SCHEMBL4561059 0.76 JAK3 (0.42) JAK3BTKPTK2JAK2TBK1
SCHEMBL24243327 0.75 JAK3 (0.58) JAK3BTKJAK2TBK1IKBKE
SCHEMBL22497050 0.74 JAK3 (1.00) JAK3BTK
SCHEMBL22497048 0.74 JAK3 (1.00) JAK3BTK
SCHEMBL24243290 0.73 JAK3 (0.59) JAK3BTKJAK2KDRAURKB
SCHEMBL19020771 0.72 AURKA (0.44) JAK3BTKTTKPTK2JAK2
SCHEMBL24243283 0.71 JAK3 (0.52) JAK3BTKTTKPTK2JAK2
SCHEMBL24243371 0.71 JAK3 (0.52) JAK3BTKPTK2
SCHEMBL8178868 0.71 TAS2R8 (0.43) JAK3JAK2TBK1IKBKEMAP4K4
Hydrochloric Acid SCHEMBL3257525 0.70 TAS2R8 (0.43) JAK3JAK2TBK1IKBKEMAP4K4

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-3950691-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS KINASE INHIBITOR Daewoong Pharmaceutical Co., Ltd. (KR) 2022-02-09 EP disclosed