SCHEMBL10776233

SCHEMBL10776233

CCCCOP(=O)(CNC(=O)c1cc(Oc2ccc(C(F)(F)F)cc2)ccc1[N+](=O)[O-])OCCCC

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ TTR P02766 1/20 0.44
▸ PPOX P50336 1/20 0.44
▸ LMNA P02545 7/20 0.41
▸ GAA P10253 3/20 0.41
▸ MAPT P10636 8/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ POLB P06746 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ THRB P10828 1/20 0.38
▸ HTT P42858 3/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ PTPN1 P18031 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
SCHEMBL10776302 0.92 MEN1 (0.46) KMT2AMEN1TDP1TTRPPOX
SCHEMBL10776134 0.89 RAB9A (0.46) LMNAMAPTPOLB
SCHEMBL10776324 0.89 TDP1 (0.61) KMT2AMEN1TDP1TTRPPOX
SCHEMBL10778468 0.85 LMNA (0.46) KMT2AMEN1TDP1TTRPPOX
SCHEMBL10776239 0.83 MEN1 (0.41) KMT2AMEN1TDP1TTRPPOX
SCHEMBL10776308 0.81 MEN1 (0.43) KMT2AMEN1TDP1TTRPPOX
SCHEMBL10776151 0.80 MEN1 (0.65) KMT2AMEN1TDP1TTRPPOX
SCHEMBL10781266 0.80 RAB9A (0.48) MAPT
SCHEMBL10778803 0.77 LMNA (0.48) KMT2AMEN1TDP1TTRPPOX
SCHEMBL9768768 0.76 MEN1 (0.48) KMT2AMEN1TDP1TTRPPOX

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-4685952-A Benzoylaminoalkylenephosphonic acids or esters thereof, herbicidal compositions containing same and their herbicidal use TEIJIN LIMITED (JP) 1987-08-11 — — US disclosed
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