SCHEMBL29324438

SCHEMBL29324438

Cn1cc(CC(=O)Nc2ccc(-c3cnn(C)c3)cn2)cn1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 13/20 0.60
DYRK1A Q13627 13/20 0.60
WNT1 P04628 12/20 0.60
MAPK8 P45983 1/20 0.56
EP300 Q09472 6/20 0.51
CLK2 P49760 1/20 0.51
CLK3 P49761 1/20 0.51

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
SCHEMBL21285856 0.90 WNT1 (0.73) GSK3BDYRK1AWNT1MAPK8EP300
SCHEMBL29640907 0.90 WNT1 (0.73) GSK3BDYRK1AWNT1MAPK8EP300
SCHEMBL22953923 0.88 EP300 (0.62) GSK3BDYRK1AWNT1MAPK8EP300
SCHEMBL21285730 0.84 EP300 (0.56) GSK3BDYRK1AWNT1MAPK8EP300
SCHEMBL22953924 0.83 MAPK8 (0.62) GSK3BDYRK1AWNT1MAPK8EP300
SCHEMBL30238335 0.82 MAP4K1 (0.55) GSK3BDYRK1AWNT1EP300
SCHEMBL28508294 0.81 CCNC (0.59) GSK3BDYRK1AWNT1EP300
SCHEMBL29337529 0.80 EP300 (0.59) GSK3BDYRK1AWNT1MAPK8EP300
SCHEMBL30238347 0.80 GSK3B (0.51) GSK3BDYRK1AWNT1EP300CLK2
SCHEMBL21426361 0.80 AURKB (0.74) GSK3BDYRK1AWNT1EP300

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-3752497-B1 P300/CBP HAT INHIBITORS CONSTELLATION PHARMACEUTICALS INC (US) 2024-07-17 EP disclosed