SCHEMBL7582297

SCHEMBL7582297

CCOC(=O)COC(=O)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-].CCc1ccc(COc2ccc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)cc2)c(OC(C)C(=O)OC)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
TTR P02766 1/20 0.40
PPOX P50336 1/20 0.40
MRGPRX4 Q96LA9 2/20 0.33
PDE5A O76074 2/20 0.32
PDE6D O43924 1/20 0.32
PDE6A P16499 1/20 0.32
PDE6G P18545 1/20 0.32
PDE6B P35913 1/20 0.32
PDE6C P51160 1/20 0.32
PDE6H Q13956 1/20 0.32
PPARG P37231 1/20 0.32
FFAR1 O14842 2/20 0.30
LMNA P02545 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 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
Acifluorfen SCHEMBL7586697 0.93 TDP1 (0.48) MEN1KMT2ATDP1TTRPPOX
Oxyfluorfen SCHEMBL7576113 0.91 MEN1 (0.38) MEN1KMT2ATDP1TTRPPOX
SCHEMBL7575888 0.82 MEN1 (0.46) MEN1KMT2ATDP1TTRPPOX
Diclofop-Methyl SCHEMBL7587664 0.81 FFAR1 (0.34) PPARGFFAR1SMN1; SMN2POLB
SCHEMBL39056 0.80 POLB (0.37) PPARGFFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL21300527 0.80 POLB (0.37) PPARGFFAR1LMNASMN1; SMN2ALDH1A1
SCHEMBL5467634 0.77 L3MBTL1 (0.39) PPARGFFAR1LMNASMN1; SMN2ALDH1A1
Diclofop-Methyl SCHEMBL7588810 0.77 TDP1 (0.55) MEN1KMT2ATDP1TTRPPOX
Aclonifen SCHEMBL7578621 0.76 MEN1 (0.33) MEN1KMT2ATDP1TTR
Clopyralid SCHEMBL7580470 0.76 PPARG (0.35) MEN1KMT2APPARGSMN1; SMN2POLB

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-20020004457-A1 Herbicidal composition SYNGENTA PARTICIPATIONS AG (CH) 2002-01-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020004457-A1 Herbicidal composition PPOX, ALAD, DDT MEN1 4274/4885KMT2A 2099/4885TDP1 1969/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.