SCHEMBL29016162

SCHEMBL29016162

Cn1cc(NNC=O)c(C(F)F)n1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 19/20 0.36
ALOX5AP P20292 1/20 0.34

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
SCHEMBL27867751 0.83 IRAK4 (0.36) IRAK4ALOX5AP
SCHEMBL28116570 0.78 LMNA (0.40) ALOX5AP
SCHEMBL19022064 0.75 IRAK4 (0.36) IRAK4ALOX5AP
SCHEMBL28954016 0.74 IRAK4 (0.38) IRAK4ALOX5AP
SCHEMBL1586647 0.70 ALDH1A1 (0.33) IRAK4
SCHEMBL16692407 0.70
Hydrazine SCHEMBL28089137 0.68 ERN1 (0.31) IRAK4
Formic Acid SCHEMBL28682501 0.67
SCHEMBL21052566 0.67 IRAK4 (0.32) IRAK4
SCHEMBL2325696 0.65 ALDH1A1 (0.31)

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-115872933-A Hydrazone compound containing pyrazole cinnamaldehyde hydrazide and preparation method and application thereof 中国农业大学 2023-03-31 CN disclosed