SCHEMBL10326774

SCHEMBL10326774

Cc1cc(C)c(C2=C(OC(=O)C(C)(C)C)CC(Cc3ccc(C#N)cc3)C2=O)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 1/20 0.34
▸ PPARG P37231 1/20 0.32
▸ PPARD Q03181 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ TRPA1 O75762 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ TAS2R14 Q9NYV8 1/20 0.31
▸ AKR1B1 P15121 1/20 0.31
▸ ELANE P08246 1/20 0.30
▸ GAA P10253 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
SCHEMBL12948988 0.87 CYP26A1 (0.34) PPARGL3MBTL1ELANE
SCHEMBL987301 0.87 ELANE (0.32) PPARGL3MBTL1ELANE
SCHEMBL10327013 0.86 L3MBTL1 (0.37) IDH1L3MBTL1ELANE
SCHEMBL10326979 0.86 ELANE (0.33) ELANE
SCHEMBL12949064 0.85 CYP26A1 (0.37) L3MBTL1ELANE
SCHEMBL10326958 0.85 TBXA2R (0.33) PPARAELANE
SCHEMBL10326978 0.83 ALDH1A1 (0.38) GAA
SCHEMBL10326957 0.82 ELANE (0.31) ELANE
SCHEMBL10327366 0.80 — —
SCHEMBL10326972 0.80 TBXA2R (0.38) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8791303-B2 Herbicides SYNGENTA LIMITED (GB) 2014-07-29 — — US disclosed
US-8791303-B2 Herbicides SYNGENTA LIMITED (GB) 2014-07-29 — — US disclosed
US-20120178623-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-07-12 — — US disclosed
US-20120178623-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-07-12 — — 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-20120178623-A1 NOVEL HERBICIDES DDT, CBR3, C9 IDH1 170/4885PPARG 2837/4885PPARD 3213/4885

“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.

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