SCHEMBL11973153

SCHEMBL11973153

CCCCC/C=C(\CC)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.43
TSHR P16473 2/20 0.37
FABP3 P05413 5/20 0.36
PPARG P37231 7/20 0.36
PPARA Q07869 2/20 0.36
TRPA1 O75762 1/20 0.36
FBP1 P09467 1/20 0.36
CA1 P00915 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
SCHEMBL11973156 1.00 EP300 (0.43) EP300TSHRFABP3PPARGPPARA
SCHEMBL11972801 0.98 EP300 (0.47) EP300TSHRFABP3PPARGPPARA
SCHEMBL11972799 0.98 EP300 (0.47) EP300TSHRFABP3PPARGPPARA
SCHEMBL8063186 0.82 BACE1 (0.33) TSHR
SCHEMBL11973013 0.82 EP300 (0.41) EP300TSHRCA1
SCHEMBL11973011 0.82 EP300 (0.41) EP300TSHRCA1
SCHEMBL28385138 0.77 EP300 (0.46) EP300TSHRPPARGPPARA
SCHEMBL11973439 0.76 EP300 (0.43) EP300TSHRPPARGPPARA
SCHEMBL1389462 0.76 GRIK1 (0.35) EP300TSHRCA1
SCHEMBL1389461 0.76 GRIK1 (0.35) EP300TSHRCA1

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
EP-2678410-B1 COMPOSIITONS COMPRISING MIXTURES OF C10-C13 ALKYLPHENYL SULFONATES PROCTER & GAMBLE (US) 2017-09-13 EP disclosed
US-9193937-B2 Mixtures of C10-C13 alkylphenyl sulfonates THE PROCTER & GAMBLE COMPANY (US) 2015-11-24 US disclosed
WO-2012138423-A1 COMPOSITIONS COMPRISING MIXTURES OF C10-C13 ALKYLPHENYL SULFONATES THE PROCTER & GAMBLE COMPANY (US) 2012-10-11 WO disclosed
US-20120214724-A1 Mixtures OF C10-C13 Alkylphenyl Sulfonates THE PROCTER & GAMBLE COMPANY 2012-08-23 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-20120214724-A1 Mixtures OF C10-C13 Alkylphenyl Sulfonates SMURF1, C1S, SMURF2 EP300 121/4885TSHR 2411/4885FABP3 2216/4885

“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.