SCHEMBL10929375

SCHEMBL10929375

N#CC(C#N)C(=O)OCC(O)CO

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
DUSP3 P51452 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
DGKA P23743 1/20 0.35
FAAH O00519 2/20 0.33
ALDH1A1 P00352 1/20 0.32
OR51E2 Q9H255 1/20 0.31

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
SCHEMBL31663241 0.78
SCHEMBL25967321 0.77 LMNA (0.42) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL7795649 0.76 LMNA (0.44) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL1933179 0.75 LMNA (0.47) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL11443945 0.74 TSHR (0.43) LMNAKDM4EMEN1KMT2AALDH1A1
SCHEMBL22283916 0.73 LMNA (0.47) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL11011933 0.73 TSHR (0.39) KDM4EALDH1A1
SCHEMBL28496592 0.73 LMNA (0.46) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL2904704 0.72 LMNA (0.48) LMNAKDM4EDUSP3MEN1KMT2A
SCHEMBL2904697 0.72 LMNA (0.48) LMNAKDM4EDUSP3MEN1KMT2A

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
US-4528357-A Curable mixtures containing hydroxyalkyl-cyanoacetates, and the use thereof for producing cured products CIBA-GEIGY CORPORATION (US) 1985-07-09 US disclosed