SCHEMBL10696959

SCHEMBL10696959

COC(=O)C(C)Oc1nc(Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
MERTK Q12866 1/20 0.53
HTT P42858 1/20 0.46
ALDH1A1 P00352 4/20 0.42
MYC P01106 2/20 0.39
MAX P61244 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
POLB P06746 1/20 0.39
GAA P10253 3/20 0.38
TXNRD1 Q16881 3/20 0.36
GSR P00390 2/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL11010421 0.87 MERTK (0.48) MAPTL3MBTL1MEN1KMT2AMERTK
SCHEMBL30806808 0.87 MERTK (0.48) MAPTL3MBTL1MEN1KMT2AMERTK
SCHEMBL22770003 0.84 ALDH1A1 (0.42) MAPTL3MBTL1MEN1KMT2AMERTK
SCHEMBL4652565 0.82 MERTK (0.58) MAPTL3MBTL1MERTKHTTALDH1A1
SCHEMBL29364572 0.82 MERTK (0.58) MAPTL3MBTL1MERTKHTTALDH1A1
SCHEMBL28468844 0.81 PIN1 (0.52) MAPTL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL28468843 0.81 PIN1 (0.52) MAPTL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL18304959 0.79 MAPT (0.49) MAPTL3MBTL1MEN1KMT2AMERTK
SCHEMBL28535414 0.79 MAPT (0.49) MAPTL3MBTL1MEN1KMT2AMERTK
SCHEMBL3251704 0.77 ALDH1A1 (0.61) MAPTL3MBTL1MEN1KMT2AHTT

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
EP-0272533-A2 Substituted phenoxypyridines BAYER AG (DE) 1988-06-29 EP disclosed