SCHEMBL6832424

SCHEMBL6832424

c1ccc(-c2cnc3nccn3c2-c2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.45
CHEK1 O14757 2/20 0.45
MAP4K4 O95819 1/20 0.45
CSF1R P07333 1/20 0.45
PRKACA P17612 1/20 0.45
CDK8 P49336 1/20 0.45
MAP2K1 Q02750 1/20 0.45
ACVR1 Q04771 1/20 0.45
MAP4K2 Q12851 1/20 0.45
ROCK1 Q13464 1/20 0.45
DYRK1A Q13627 1/20 0.45
AURKB Q96GD4 1/20 0.45
DYRK1B Q9Y463 1/20 0.45
CCNE1 P24864 1/20 0.42
CDK2 P24941 1/20 0.42
BACE1 P56817 2/20 0.40
ROCK2 O75116 1/20 0.39
PIM1 P11309 1/20 0.39
GSK3B P49841 1/20 0.39
EED O75530 1/20 0.39

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
SCHEMBL2650737 0.69 BACE1 (0.77) KDRCHEK1MAP4K4CSF1RPRKACA
SCHEMBL18104238 0.68 KDM4E (0.55) ROCK2PIM1GSK3BAKT1AKT2
SCHEMBL9870091 0.67 KDM4E (0.55) KDRCHEK1MAP4K4CSF1RPRKACA
SCHEMBL31605956 0.66 BACE1 (0.40) KDRCHEK1MAP4K4CSF1RPRKACA
SCHEMBL5909487 0.66 BACE1 (0.40) KDRCHEK1MAP4K4CSF1RPRKACA
SCHEMBL13820894 0.66 AKT1 (0.67) ROCK2PIM1GSK3BAKT1AKT2
SCHEMBL20019362 0.64 ROCK2 (0.50) KDRCHEK1MAP4K4CSF1RPRKACA
SCHEMBL19060930 0.64 KLK7 (0.65) BACE1ROCK2PIM1GSK3BAKT1
SCHEMBL2834048 0.64 GABRA1 (0.44) KDM4EALDH1A1HPGDHSD17B10CYP1A2
SCHEMBL360651 0.64 DYRK1A (0.74) KDRCHEK1MAP4K4CSF1RPRKACA

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
JP-2004002315-A 5,6-DIPHENYLIMIDAZO[1,2-a]PYRIMIDINE AND ITS APPLICATION SUMITOMO CHEM CO LTD 2004-01-08 JP disclosed