SCHEMBL28556801

SCHEMBL28556801

Fc1cc(-c2n[nH]c3ncc(Br)cc23)ccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.44
MAPK1 P28482 5/20 0.43
MAPT P10636 5/20 0.40
DYRK1A Q13627 3/20 0.39
NFATC1 O95644 1/20 0.39
MAP4K4 O95819 3/20 0.39
MINK1 Q8N4C8 3/20 0.39
TNIK Q9UKE5 1/20 0.39
DYRK1B Q9Y463 2/20 0.38
PRKD3 O94806 2/20 0.38
FER P16591 2/20 0.38
CDK2 P24941 2/20 0.38
MARK3 P27448 2/20 0.38
FLT4 P35916 2/20 0.38
FLT3 P36888 2/20 0.38
CLK2 P49760 2/20 0.38
CSNK2A1 P68400 2/20 0.38
MAP4K2 Q12851 2/20 0.38
STK3 Q13188 2/20 0.38
CAMK2B Q13554 2/20 0.38

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
SCHEMBL28560103 0.84 LRRK2 (0.48) MAPK1MAPTDYRK1AMAP4K4MINK1
SCHEMBL28559332 0.83 DYRK1A (0.44) MAPK1DYRK1AMAP4K4MINK1DYRK1B
SCHEMBL28553364 0.81 DYRK1B (0.39) DYRK1AMAP4K4MINK1DYRK1BPRKD3
SCHEMBL16025493 0.79 FLT3 (0.62) IDO1MAPK1MAPTDYRK1ANFATC1
SCHEMBL5061384 0.78 DYRK1A (0.57) IDO1DYRK1AMAP4K4MINK1DYRK1B
SCHEMBL28603327 0.77 DYRK1A (0.63) IDO1MAPK1DYRK1ANFATC1MAP4K4
SCHEMBL29930372 0.77 DYRK1B (0.60) DYRK1AMAP4K4MINK1DYRK1BPRKD3
SCHEMBL28558865 0.76 DYRK1A (0.34) DYRK1AMAP4K4MINK1DYRK1BPRKD3
SCHEMBL29930770 0.76 DYRK1B (0.58) IDO1MAPK1DYRK1AMAP4K4MINK1
SCHEMBL29930377 0.75 DYRK1B (0.61) DYRK1AMAP4K4MINK1DYRK1BPRKD3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112724134-B Azaindazole bipyridine derivative myeloid cell proliferation inhibitor, preparation method and application thereof in pharmacy 复旦大学 2022-04-01 CN disclosed
CN-112724134-A Azaindazole bipyridine derivative myeloid cell proliferation inhibitor, preparation method and application thereof in pharmacy 复旦大学 2021-04-30 CN disclosed