SCHEMBL31601656

SCHEMBL31601656

Oc1ccc2nccn2c1Br

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.38
CDK8 P49336 2/20 0.38
ROCK1 Q13464 2/20 0.38
CHEK1 O14757 1/20 0.38
MAP4K4 O95819 1/20 0.38
CSF1R P07333 1/20 0.38
PRKACA P17612 1/20 0.38
KDR P35968 1/20 0.38
MAP2K1 Q02750 1/20 0.38
ACVR1 Q04771 1/20 0.38
MAP4K2 Q12851 1/20 0.38
AURKB Q96GD4 1/20 0.38
DYRK1B Q9Y463 1/20 0.38
FLT1 P17948 1/20 0.34
CDK9 P50750 1/20 0.34
LIMK1 P53667 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL27385858 0.80 CDK8 (0.41) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL27374115 0.76 DYRK1A (0.38) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL15688160 0.76 CDK8 (0.45) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL2673935 0.76 DYRK1A (0.38) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL25383486 0.72 MC4R (0.38) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL1154880 0.68 CDK8 (0.41) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL5572841 0.68 CDK8 (0.41) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL18319487 0.68 DYRK1A (0.38) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL21290406 0.67 KDR (0.38) DYRK1ACDK8ROCK1CHEK1MAP4K4
SCHEMBL19697361 0.67 CDK8 (0.38) DYRK1ACDK8ROCK1CHEK1MAP4K4

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
CN-120077048-A Tricyclic compounds and uses thereof 诺华股份有限公司 2025-05-30 CN disclosed