SCHEMBL30731289

SCHEMBL30731289

O=C(O)c1cnc2[nH]cc(Br)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 9/20 0.45
CAMKK2 Q96RR4 4/20 0.45
SGK1 O00141 2/20 0.45
POLB P06746 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
DYRK1A Q13627 4/20 0.40
CLK1 P49759 2/20 0.40
DYRK1B Q9Y463 2/20 0.40
PLK4 O00444 2/20 0.39
AURKA O14965 2/20 0.39
ROCK2 O75116 2/20 0.39
PRKD3 O94806 2/20 0.39
INSR P06213 2/20 0.39
CDK1 P06493 2/20 0.39
FES P07332 2/20 0.39
ROS1 P08922 2/20 0.39
FGFR1 P11362 2/20 0.39
PHKG2 P15735 2/20 0.39
FER P16591 2/20 0.39
FLT1 P17948 2/20 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
SCHEMBL22554109 1.00 AXL (0.45) AXLCAMKK2SGK1POLBHCAR2
SCHEMBL22554203 0.85 SGK1 (0.45) AXLCAMKK2SGK1DYRK1ACLK1
SCHEMBL30731143 0.85 SGK1 (0.45) AXLCAMKK2SGK1DYRK1ACLK1
SCHEMBL20780050 0.83 AXL (0.47) AXLCAMKK2SGK1MAPK1
SCHEMBL30731267 0.83 DYRK1A (0.47) AXLDYRK1ACLK1DYRK1BROCK2
SCHEMBL22554153 0.83 DYRK1A (0.47) AXLDYRK1ACLK1DYRK1BROCK2
SCHEMBL30504208 0.83 AXL (0.47) AXLCAMKK2SGK1MAPK1
SCHEMBL22554074 0.81 MAP4K1 (0.48) AXLDYRK1ACLK1DYRK1BIGF1R
SCHEMBL30731147 0.81 MAP4K1 (0.48) AXLDYRK1ACLK1DYRK1BIGF1R
SCHEMBL2671287 0.80 AXL (0.45) AXLCAMKK2SGK1HCAR2ITK

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-112088157-B Aryl-bipyridylamine derivatives as phosphatidylinositol phosphokinase inhibitors 拉文纳制药公司 2023-12-26 CN disclosed