SCHEMBL24867263

SCHEMBL24867263

Cc1cnccc1Nc1cnc(NC2CCOCC2)nc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 7/20 0.56
▸ AOC3 Q16853 4/20 0.47
▸ MAPK3 P27361 2/20 0.45
▸ PIK3C3 Q8NEB9 2/20 0.44
▸ PIK3CD O00329 1/20 0.44
▸ HDAC3 O15379 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC2 Q92769 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ KCNH2 Q12809 1/20 0.42
▸ OPRL1 P41146 2/20 0.41
▸ FYN P06241 1/20 0.39
▸ MKNK1 Q9BUB5 1/20 0.39
▸ PLK4 O00444 1/20 0.39
▸ MAPK8 P45983 1/20 0.38
▸ MAPK9 P45984 1/20 0.38
▸ MAPK10 P53779 1/20 0.38

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
SCHEMBL24867261 0.84 MAP4K1 (0.42) AOC3HDAC1
SCHEMBL24866931 0.84 AOC3 (0.38) MAPK1AOC3MAPK3PIK3C3PIK3CD
SCHEMBL24866922 0.84 MAPK1 (0.36) MAPK1AOC3MAPK3PIK3C3PIK3CD
SCHEMBL24867267 0.83 DYRK1A (0.41) MAPK1AOC3MAPK3MKNK1MAPK8
SCHEMBL23408943 0.82 MAPK1 (0.67) MAPK1AOC3MAPK3KCNH2
SCHEMBL24867264 0.80 AOC3 (0.36) MAPK1AOC3MAPK8MAPK9
SCHEMBL24867273 0.80 AOC3 (0.36) MAPK1AOC3MAPK8MAPK9
SCHEMBL24867265 0.79 ROCK2 (0.53) AOC3
SCHEMBL16067939 0.74 HDAC1 (0.52) MAPK1AOC3MAPK3PIK3C3PIK3CD
SCHEMBL19144932 0.73 MAPK1 (1.00) MAPK1AOC3MAPK3PIK3C3HDAC3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023283488-A9 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CZ BIOHUB SF, LLC (US) 2023-05-25 — — WO disclosed
WO-2023283488-A2 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CHAN ZUCKERBERG BIOHUB, INC. (US) 2023-01-12 — — WO disclosed
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