SCHEMBL1697967

SCHEMBL1697967

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nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.38
GRIK2 Q13002 1/20 0.38
PTGS1 P23219 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
TSHR P16473 1/20 0.32
ALOX15 P16050 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
SCHEMBL9985312 1.00 GRIK1 (0.38) GRIK1GRIK2PTGS1CYP2D6CYP2C19
SCHEMBL9985313 1.00 GRIK1 (0.38) GRIK1GRIK2PTGS1CYP2D6CYP2C19
SCHEMBL1302324 0.86 GRIK1 (0.40) GRIK1GRIK2PTGS1CYP2D6CYP2C19
SCHEMBL132576 0.86 GRIK1 (0.40) GRIK1GRIK2PTGS1CYP2D6CYP2C19
SCHEMBL15681239 0.83 GRIK1 (0.36) GRIK1GRIK2TSHR
SCHEMBL15669528 0.83 GRIK1 (0.36) GRIK1GRIK2TSHR
SCHEMBL23923660 0.83 GRIK1 (0.38) GRIK1GRIK2PTGS1CYP2D6CYP2C19
SCHEMBL9323887 0.83 TSHR (0.52) GRIK1GRIK2PTGS1CYP2D6CYP2C19
Acetic Acid SCHEMBL8154336 0.83 GRIK1 (0.41) GRIK1GRIK2PTGS1CYP2D6CYP2C19
SCHEMBL336388 0.81 GRIK1 (0.37) GRIK1GRIK2PTGS1TSHRALOX15

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
EP-2585569-A1 PERFUME SYSTEMS The Procter and Gamble Company (US) 2013-05-01 EP claimed
WO-2011163337-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 2011-12-29 WO claimed
US-20110308555-A1 PERFUME SYSTEMS PROCTER & GAMBLE COMPANY, THE 2011-12-22 US claimed
EP-3085759-B1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2018-02-07 EP disclosed
EP-3085759-A2 PERFUME SYSTEMS The Procter and Gamble Company (US) 2016-10-26 EP disclosed
EP-2585569-B1 PERFUME SYSTEMS PROCTER & GAMBLE (US) 2016-08-24 EP disclosed
US-8609603-B2 Perfume systems THE PROCTER & GAMBLE COMPANY (US) 2013-12-17 US disclosed
US-20110308555-A1 PERFUME SYSTEMS PROCTER & GAMBLE COMPANY, THE 2011-12-22 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-20110308555-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 GRIK1 3782/4885GRIK2 3356/4885PTGS1 760/4885

“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.