SCHEMBL29664428

SCHEMBL29664428

Fc1cnc(Nc2nccn3cc(Br)nc23)nc1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.32
TMIGD3 P0DMS9 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
AURKA O14965 1/20 0.30

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
SCHEMBL29664232 0.73 AURKA (0.53) TMIGD3ADORA3AURKA
SCHEMBL24864096 0.72 CYP1A2 (0.40) HTR2CL3MBTL1AURKA
SCHEMBL3804294 0.68 GPR119 (0.38)
SCHEMBL29664463 0.66 AURKA (0.64) AURKA
SCHEMBL2273731 0.65 HTR2C (0.47) HTR2CL3MBTL1AURKA
SCHEMBL103894 0.65 HTR2C (0.53) HTR2CL3MBTL1AURKA
SCHEMBL29893796 0.64 ADORA2A (0.45) HTR2CL3MBTL1
SCHEMBL15956956 0.63 AURKA (0.50) HTR2CAURKA
SCHEMBL2221438 0.63 AURKA (0.60) HTR2CAURKA
SCHEMBL19865160 0.62 L3MBTL1 (0.53) HTR2CL3MBTL1

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-113480543-B 2,6, 8-polysubstituted imidazo [1,2-a ] pyrazine and synthetic method and application thereof 无锡市第二人民医院 2022-05-17 CN disclosed