SCHEMBL11259232

SCHEMBL11259232

CCOP(=O)(OCC)Sc1ccccc1[N+](=O)[O-]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
KMT2A Q03164 3/20 0.45
LMNA P02545 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 2/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
ALPG P10696 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PDE7A Q13946 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
KCNH2 Q12809 1/20 0.41
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
BCHE P06276 1/20 0.40

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
SCHEMBL4300849 0.77 ALDH1A1 (0.49) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL18261814 0.74 PDE7A (0.50) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL642380 0.73 MEN1 (0.48) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL10958497 0.72 ALDH1A1 (0.46) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL2802945 0.72 CA1 (0.56) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL3386571 0.72 MEN1 (0.53) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL3182861 0.71 CA1 (0.55) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL31688384 0.71 ALDH1A1 (0.51) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL917444 0.71 ALDH1A1 (0.51) ALDH1A1KMT2ALMNATDP1MEN1
SCHEMBL642548 0.71 ALDH1A1 (0.49) ALDH1A1KMT2ALMNATDP1MEN1

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-4342176-A Unit dosage system for tree trunk implantation to control insect pests afflicting trees WOLFE WARREN D 1982-08-03 US disclosed