SCHEMBL5076982

SCHEMBL5076982

COC=C(C(=O)O)c1ccccc1COc1cc(Cl)c(OCC(C)(C)C)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.38
HTT P42858 1/20 0.38
MRGPRX4 Q96LA9 3/20 0.38
NR4A2 P43354 2/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
HIF1A Q16665 3/20 0.36
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ABL1 P00519 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35
RIN1 Q13671 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BCL2 P10415 1/20 0.33

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
SCHEMBL5076975 1.00 TP53 (0.38) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5077003 0.91 MRGPRX4 (0.38) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5077012 0.91 MRGPRX4 (0.38) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5076979 0.91 TP53 (0.40) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5074565 0.90 TP53 (0.37) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5074561 0.90 TP53 (0.37) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5075974 0.89 RAB9A (0.46) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5075979 0.89 RAB9A (0.46) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5079484 0.88 MRGPRX4 (0.44) TP53HTTMRGPRX4NR4A2RAB9A
SCHEMBL5079482 0.88 MRGPRX4 (0.44) TP53HTTMRGPRX4NR4A2RAB9A

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.