SCHEMBL5075822

SCHEMBL5075822

COC=C(C(=O)O)c1ccccc1COc1cc(Cl)c(OCC2CCCCC2)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.39
THRB P10828 2/20 0.39
SLC16A3 O15427 2/20 0.38
SLC16A1 P53985 2/20 0.38
MCTS1 Q9ULC4 2/20 0.38
PARP15 Q460N3 1/20 0.37
PARP10 Q53GL7 1/20 0.37
FABP4 P15090 2/20 0.36
HRH3 Q9Y5N1 1/20 0.36
RHEB Q15382 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
PTGS1 P23219 1/20 0.35
TP53 P04637 1/20 0.35
HTT P42858 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35

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
SCHEMBL5079635 1.00 THRA (0.39) THRATHRBSLC16A3SLC16A1MCTS1
SCHEMBL5077005 0.97 SLC16A3 (0.38) THRATHRBSLC16A3SLC16A1MCTS1
SCHEMBL5077019 0.97 SLC16A3 (0.38) THRATHRBSLC16A3SLC16A1MCTS1
SCHEMBL5074588 0.95 TP53 (0.37) SLC16A3SLC16A1MCTS1TP53HTT
SCHEMBL5074596 0.95 TP53 (0.37) SLC16A3SLC16A1MCTS1TP53HTT
SCHEMBL5077013 0.89 SLC16A3 (0.40) THRATHRBSLC16A3SLC16A1MCTS1
SCHEMBL5077046 0.88 KMT2A (0.37) THRATHRBHRH3TP53HTT
SCHEMBL5077053 0.88 KMT2A (0.37) THRATHRBHRH3TP53HTT
SCHEMBL5075987 0.87 KMT2A (0.38) HRH3TP53HTTNPC1RAB9A
SCHEMBL5075986 0.87 KMT2A (0.38) HRH3TP53HTTNPC1RAB9A

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 8 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 claimed
US-20060235075-A1 Analogous compounds of strobilurines and their use as acaricides and insecticides ISAGRO RICERCA S.R.L. (IT) 2006-10-19 US claimed
EP-1494991-A1 ANALOGOUS COMPOUNDS OF STROBILURINES AND THEIR USE AS ACARICIDES AND INSECTICIDES Isagro Ricerca S.r.l. (IT) 2005-01-12 EP claimed
WO-2003087032-A1 ANALOGOUS COMPOUNDS OF STROBILURINES AND THEIR USE AS ACARICIDES AND INSECTICIDES ISAGRO RICERCA S.R.L. (IT) 2003-10-23 WO claimed
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
EP-1494991-A1 ANALOGOUS COMPOUNDS OF STROBILURINES AND THEIR USE AS ACARICIDES AND INSECTICIDES Isagro Ricerca S.r.l. (IT) 2005-01-12 EP disclosed
WO-2003087032-A1 ANALOGOUS COMPOUNDS OF STROBILURINES AND THEIR USE AS ACARICIDES AND INSECTICIDES ISAGRO RICERCA S.R.L. (IT) 2003-10-23 WO 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 THRA 3390/4885THRB 2809/4885SLC16A3 2720/4885

“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.