SCHEMBL4735801

SCHEMBL4735801

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nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL4736556 1.00 TSHR (0.31) TSHRALDH1A1HSD17B10
SCHEMBL17866508 0.86 TSHR (0.31) TSHRALDH1A1HSD17B10
SCHEMBL4787362 0.82 SMN1; SMN2 (0.37) TSHRALDH1A1
SCHEMBL1866475 0.80 TSHR (0.43) TSHRALDH1A1HSD17B10
SCHEMBL580557 0.80 TSHR (0.43) TSHRALDH1A1HSD17B10
SCHEMBL17617132 0.80 TSHR (0.43) TSHRALDH1A1HSD17B10
SCHEMBL13541326 0.80 TSHR (0.43) TSHRALDH1A1HSD17B10
SCHEMBL2978632 0.78 MAPT (0.42) TSHRALDH1A1HSD17B10
SCHEMBL25875641 0.78 CTSK (0.34) TSHRALDH1A1HSD17B10
SCHEMBL4439936 0.78 MAPT (0.42) TSHRALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324273-B2 Catechol protected levodopa diester prodrugs, compositions, and methods of use XENOPORT, INC. (US) 2012-12-04 US disclosed
US-20080171789-A1 Catechol protected levodopa diester prodrugs, compositions, and methods of use XENOPORT, INC. 2008-07-17 US disclosed
WO-2008079387-A1 CATECHOL PROTECTED LEVODOPA DIESTER PRODRUGS, COMPOSITIONS, AND METHODS OF USE XENOPORT, INC. (US) 2008-07-03 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-20080171789-A1 Catechol protected levodopa diester prodrugs, compositions, and methods of use COMT, PARK7, DDT TSHR 3809/4885ALDH1A1 636/4885HSD17B10 1201/4885

“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.