SCHEMBL12930306

SCHEMBL12930306

Cc1ccc2c(c1)/C(=C\C(=O)O)C(=O)N2Cc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 4/20 0.74
▸ ACHE P22303 1/20 0.50
▸ CDC25A P30304 9/20 0.49
▸ HSP90AA1 P07900 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ ALDH2 P05091 2/20 0.47
▸ ALDH3A1 P30838 2/20 0.47

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
SCHEMBL12930218 0.87 TRPA1 (0.57) TRPA1ACHECDC25AHSP90AA1ALDH1A1
SCHEMBL12930177 0.85 TRPA1 (0.61) TRPA1CDC25A
SCHEMBL1061089 0.85 TRPA1 (1.00) TRPA1CDC25AALDH1A1ALDH2ALDH3A1
SCHEMBL1061091 0.85 TRPA1 (1.00) TRPA1CDC25AALDH1A1ALDH2ALDH3A1
SCHEMBL12930285 0.84 TRPA1 (0.69) TRPA1CDC25A
SCHEMBL1061470 0.84 TRPA1 (0.72) TRPA1CDC25AALDH1A1ALDH2ALDH3A1
SCHEMBL1061471 0.84 TRPA1 (0.72) TRPA1CDC25AALDH1A1ALDH2ALDH3A1
SCHEMBL13652120 0.83 TRPA1 (0.68) TRPA1CDC25AALDH1A1ALDH2ALDH3A1
SCHEMBL29260669 0.81 CASP1 (0.52) TRPA1ACHEHSP90AA1ALDH1A1ALDH2
SCHEMBL29260666 0.81 CASP1 (0.52) TRPA1ACHEHSP90AA1ALDH1A1ALDH2

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-20110009379-A1 INDOLINONE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-01-13 — — US disclosed
US-20110009379-A1 INDOLINONE COMPOUND ASTELLAS PHARMA INC. (JP) 2011-01-13 — — US disclosed
EP-2261206-A1 INDOLINONE COMPOUND Astellas Pharma Inc. (JP) 2010-12-15 — — EP disclosed
WO-2009123080-A1 INDOLINONE COMPOUND アステラス製薬株式会社 (JP) 2009-10-08 — — 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-20110009379-A1 INDOLINONE COMPOUND TRPA1, TRPV1, TRPV6 TRPA1 1/4885ACHE 209/4885CDC25A 2321/4885

“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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