SCHEMBL29178674

SCHEMBL29178674

FC(F)C(F)Oc1ncnc2cc[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.46
EIF4E P06730 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
EGFR P00533 8/20 0.32
ERBB2 P04626 8/20 0.32
ERBB3 P21860 8/20 0.32
ERBB4 Q15303 8/20 0.32
TRPA1 O75762 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL15612939 0.74 DYRK1A (0.53) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL29178671 0.71 DYRK1A (0.46) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL13768011 0.68 KDM4E (0.49) DYRK1AMKNK2IRAK4EGFRERBB2
SCHEMBL16432196 0.67 TRPA1 (0.55) DYRK1AEGFRERBB2ERBB3ERBB4
SCHEMBL23158613 0.64 DYRK1A (0.64) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL8223 0.64 DYRK1A (1.00) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL3386908 0.64 DYRK1A (0.59) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL29702869 0.64 DYRK1A (0.59) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL1056424 0.64 DYRK1A (0.59) DYRK1AEIF4EMKNK1MKNK2IRAK4
SCHEMBL13186164 0.64 DYRK1A (0.59) DYRK1AEIF4EMKNK1MKNK2IRAK4

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-117466897-A Highly selective FGFR2 inhibitors 深圳福沃药业有限公司 2024-01-30 CN disclosed