SCHEMBL28875294

SCHEMBL28875294

C=CC(=O)C#N.C=CC(=O)C#N

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
ALDH1A1 P00352 6/20 0.37
TSHR P16473 5/20 0.37
TDP1 Q9NUW8 1/20 0.37
FGFR4 P22455 1/20 0.37
TP53 P04637 1/20 0.32

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
SCHEMBL5515101 1.00
SCHEMBL2295679 0.73
Acrylic Acid SCHEMBL551151 0.71 TDP1 (0.58) LMNAALDH1A1TSHRTDP1FGFR4
Acrylic Acid SCHEMBL27967207 0.71 LMNA (0.53) LMNAALDH1A1TSHRTDP1FGFR4
Acrylamide SCHEMBL28165748 0.71 ALDH1A1 (0.58) LMNAALDH1A1TSHRTDP1FGFR4
Acrylamide SCHEMBL913706 0.69 ALDH1A1 (0.55) LMNAALDH1A1TSHRTDP1FGFR4
Acrylic Acid SCHEMBL10661862 0.69 LMNA (0.50) LMNAALDH1A1TSHR
Acrylic Acid SCHEMBL4727364 0.69 LMNA (0.50) LMNAALDH1A1TSHR
SCHEMBL673407 0.69
SCHEMBL8590934 0.69

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-109912416-A The method that catalytic oxidation prepares glufosinate-ammonium and L- phosphine oxamate key intermediate 洪湖市一泰科技有限公司 2019-06-21 CN disclosed