SCHEMBL11264191

SCHEMBL11264191

O=C(O)c1cc(Oc2ccc(Cl)cc2Cl)cc(CC=CCO)c1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TTR P02766 2/20 0.42
PPOX P50336 1/20 0.42
MRGPRX4 Q96LA9 7/20 0.41
GAA P10253 3/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
FFAR1 O14842 2/20 0.39
CHRM1 P11229 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL10500431 0.88 MEN1 (0.60) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10500441 0.88 MEN1 (0.60) TDP1MEN1KMT2ATTRPPOX
SCHEMBL9852601 0.85 TDP1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11063376 0.83 POLB (0.46) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11263525 0.82 TDP1 (0.46) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11263520 0.82 TDP1 (0.46) TDP1MEN1KMT2ATTRPPOX
SCHEMBL3304697 0.79 TDP1 (0.56) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11490991 0.76 MEN1 (0.62) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11266666 0.75 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11266661 0.75 MEN1 (0.54) TDP1MEN1KMT2ATTRPPOX

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-0066106-A1 New phenoxybenzoates, process for preparing these compounds, compositions containing them and method of use GAF CORPORATION (US) 1982-12-08 EP disclosed