SCHEMBL5074500

SCHEMBL5074500

CC(C)=C(C(=O)O)c1ccccc1COc1cc(Cl)c(OC(F)(F)C(F)OC(F)(F)F)c(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
HTT P42858 1/20 0.35
MRGPRX4 Q96LA9 4/20 0.35
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34
NR4A2 P43354 2/20 0.33
SCN9A Q15858 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
HIF1A Q16665 4/20 0.33
BCL2 P10415 2/20 0.33
MCL1 Q07820 2/20 0.33
LNPEP Q9UIQ6 2/20 0.32
GSTP1 P09211 1/20 0.32

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
SCHEMBL5074501 0.93 HIF1A (0.35) TP53HTTMRGPRX4MAOAMAOB
SCHEMBL5074555 0.91 TP53 (0.38) TP53HTTMRGPRX4MAOAMAOB
SCHEMBL5074512 0.90 TP53 (0.37) TP53HTTMRGPRX4MAOAMAOB
SCHEMBL6150433 0.85 HIF1A (0.33) TP53HTTMRGPRX4NR4A2SCN9A
SCHEMBL5076937 0.85 HIF1A (0.37) TP53HTTMRGPRX4NR4A2SCN9A
SCHEMBL6150429 0.85 HIF1A (0.33) TP53HTTMRGPRX4NR4A2SCN9A
SCHEMBL5074558 0.84 MRGPRX4 (0.37) TP53HTTMRGPRX4MAOAMAOB
SCHEMBL5074514 0.82 MRGPRX4 (0.36) TP53HTTMRGPRX4MAOAMAOB
SCHEMBL5076935 0.81 HIF1A (0.55) TP53HTTMRGPRX4MAOAMAOB
SCHEMBL5074499 0.80 HIF1A (0.38) MRGPRX4SCN9AHIF1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7435844-B2 Analogous compounds of strobilurines and their use as acaricides and insecticides ISAGRO RICERCA S.R.L. (IT) 2008-10-14 US disclosed
US-20060235075-A1 Analogous compounds of strobilurines and their use as acaricides and insecticides ISAGRO RICERCA S.R.L. (IT) 2006-10-19 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-20060235075-A1 Analogous compounds of strobilurines and their use as acaricides and insecticides DDT, RYR1, TPMT TP53 2842/4885HTT 4420/4885MRGPRX4 989/4885

“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.