SCHEMBL4396604

SCHEMBL4396604

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nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
TSHR P16473 2/20 0.38
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL4400597 0.84 TSHR (0.55) MAPTTSHRNPSR1
SCHEMBL4405422 0.83 MAPT (0.40) MAPTTSHRNPSR1
SCHEMBL4405421 0.83 MAPT (0.40) MAPTTSHRNPSR1
SCHEMBL3504566 0.82 MAPT (0.42) MAPTTSHRNPSR1
SCHEMBL11747186 0.79 MAPT (0.46) MAPTTSHRNPSR1
SCHEMBL28367450 0.79 MAPT (0.46) MAPTTSHRNPSR1
SCHEMBL697129 0.78 MAPT (0.44) MAPTTSHR
SCHEMBL15243937 0.76 TSHR (0.67) MAPTTSHR
SCHEMBL29362562 0.76 TSHR (0.67) MAPTTSHR
SCHEMBL35200 0.76 TSHR (0.67) MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060142177-A1 Organic compounds GIVAUDAN SA (CH) 2006-06-29 US claimed
EP-1633693-A1 IMPROVEMENTS IN OR RELATED TO ORGANIC COMPOUNDS Givaudan SA (CH) 2006-03-15 EP claimed
WO-2004108653-A1 IMPROVEMENTS IN OR RELATED TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2004-12-16 WO claimed
US-7632964-B2 2-methylbutyl 3-methylbutenoate; enhance, improve, or modify the aroma or flavour in food, beverage, pharmaceutical, oral hygiene product or healthcare product GIVAUDAN S.A. (CH) 2009-12-15 US disclosed
US-20060142177-A1 Organic compounds GIVAUDAN SA (CH) 2006-06-29 US disclosed
EP-1633693-A1 IMPROVEMENTS IN OR RELATED TO ORGANIC COMPOUNDS Givaudan SA (CH) 2006-03-15 EP disclosed
WO-2004108653-A1 IMPROVEMENTS IN OR RELATED TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2004-12-16 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-20060142177-A1 Organic compounds ELOVL1, ELOVL5, ELOVL3 MAPT 3572/4885TSHR 2537/4885NPSR1 2626/4885

“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.