SCHEMBL11237751

SCHEMBL11237751

CC1C/C(=N/O)CC(C)(C)C1.[NaH]

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.49
NPSR1 Q6W5P4 5/20 0.49
KDM4E B2RXH2 5/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
GAA P10253 2/20 0.43
KMT2A Q03164 2/20 0.43
ALOX12 P18054 1/20 0.43
MAPT P10636 5/20 0.42
LMNA P02545 3/20 0.42
RECQL P46063 1/20 0.42
MAPK1 P28482 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.37
PLA2G1B P04054 1/20 0.34
ATG4B Q9Y4P1 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
SCHEMBL11237755 1.00 ALDH1A1 (0.49) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL2735553 0.98 ALDH1A1 (0.50) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL17135973 0.98 ALDH1A1 (0.50) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL7555797 0.98 ALDH1A1 (0.50) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL11342557 0.77 ALDH1A1 (0.37) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL7537547 0.74 ALDH1A1 (0.48) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL7542696 0.74 ALDH1A1 (0.48) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL11206930 0.73 ALDH1A1 (0.47) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL11206934 0.73 ALDH1A1 (0.47) ALDH1A1NPSR1KDM4EHTTTDP1
SCHEMBL1931577 0.73 ALDH1A1 (0.43) ALDH1A1NPSR1KDM4EHTTTDP1

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-4329488-A Propionic acid esters and herbicidal use thereof HOFFMANN-LA ROCHE INC. (US) 1982-05-11 US disclosed