SCHEMBL11292229

SCHEMBL11292229

COP(C)(=O)c1cc(Oc2c(F)c(F)c(C)c(F)c2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.34
▸ HTT P42858 2/20 0.34
▸ TDP1 Q9NUW8 3/20 0.33
▸ MERTK Q12866 1/20 0.33
▸ MAPT P10636 4/20 0.32
▸ POLB P06746 2/20 0.32
▸ MEN1 O00255 4/20 0.31
▸ KMT2A Q03164 4/20 0.31
▸ TTR P02766 2/20 0.31
▸ ALB P02768 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ PDE7A Q13946 1/20 0.31
▸ LMNA P02545 4/20 0.30
▸ KIF11 P52732 1/20 0.30
▸ SMN1; SMN2 Q16637 2/20 0.30
▸ MITF O75030 1/20 0.30
▸ CCR6 P51684 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ HPGD P15428 2/20 0.30
▸ RAF1 P04049 1/20 0.30

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
SCHEMBL11295140 0.89 ALDH1A1 (0.33) ALDH1A1HTTTDP1MERTKMAPT
SCHEMBL11291228 0.88 MEN1 (0.38) ALDH1A1HTTTDP1MAPTPOLB
SCHEMBL10855395 0.85 TDP1 (0.32) ALDH1A1HTTTDP1MAPTPOLB
SCHEMBL11290598 0.84 — —
SCHEMBL11288556 0.83 MAPT (0.34) ALDH1A1HTTTDP1MAPTPOLB
SCHEMBL11287905 0.83 ALDH1A1 (0.46) ALDH1A1HTTTDP1MERTKMAPT
Hydrochloric Acid SCHEMBL10854582 0.82 MAPT (0.33) ALDH1A1HTTTDP1MAPTPOLB
SCHEMBL10766268 0.82 TDP1 (0.42) ALDH1A1HTTTDP1MERTKMAPT
SCHEMBL11285449 0.82 MEN1 (0.35) ALDH1A1TDP1MAPTPOLBMEN1
SCHEMBL11411623 0.81 MEN1 (0.38) ALDH1A1HTTTDP1MERTKMAPT

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-0065374-A1 Substituted phosphinates and phosphinothioates and their use for the control of weeds ZOECON CORPORATION (US) 1982-11-24 — — EP disclosed
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