SCHEMBL20415021

SCHEMBL20415021

CC(=O)NC1C(O)C(O)C(COS(=O)(=O)O)OC1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BDNF P23560 3/20 0.38
▸ PTN P21246 2/20 0.38
▸ MDK P21741 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ CD69 Q07108 1/20 0.35
▸ F10 P00742 1/20 0.35
▸ HPSE Q9Y251 2/20 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
SCHEMBL17689074 0.88 MAPK1 (0.45) BDNFPTNMDKALDH1A1THRB
SCHEMBL30089326 0.88 MAPK1 (0.45) BDNFPTNMDKALDH1A1THRB
SCHEMBL22362645 0.88 MAPK1 (0.45) BDNFPTNMDKALDH1A1THRB
SCHEMBL15966272 0.88 MAPK1 (0.45) BDNFPTNMDKALDH1A1THRB
SCHEMBL15965653 0.88 MAPK1 (0.45) BDNFPTNMDKALDH1A1THRB
SCHEMBL23631128 0.88 MAPK1 (0.45) BDNFPTNMDKALDH1A1THRB
SCHEMBL15966248 0.88 MAPK1 (0.45) BDNFPTNMDKALDH1A1THRB
SCHEMBL20474503 0.88 MAPK1 (0.45) BDNFPTNMDKALDH1A1THRB
SCHEMBL16566075 0.84 ALDH1A1 (0.40) BDNFPTNMDKALDH1A1THRB
Phosphoric Acid SCHEMBL27756060 0.83 AMDHD2 (0.46) BDNFPTNMDKALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203082-A1 REAGENTS AND METHODS FOR SCREENING MPS I, II, IIIA, IIIB, IVA, VI, AND VII UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2023-06-29 — — US disclosed
US-10788499-B2 Methods for assaying palmitoyl protein thioesterase 1 and tripeptidyl peptidase activity in dried blood spots for detection of neuronal ceroid lipofuscinoses in newborns UNIVERSITY OF WASHINGTON (US) 2020-09-29 — — US disclosed
US-20190144916-A1 REAGENTS AND METHODS FOR SCREENING MPS I, II, IIIA, IIIB, IVA, VI, AND VII UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2019-05-16 — — US disclosed
US-10196668-B2 Reagents and methods for screening MPS I, II, IIIA, IIIB, IVA, VI, and VII UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2019-02-05 — — US disclosed
US-20180209989-A1 METHODS FOR ASSAYING PALMITOYL PROTEIN THIOESTERASE 1 AND TRIPEPTIDYL PEPTIDASE ACTIVITY IN DRIED BLOOD SPOTS FOR DETECTION OF NEURONAL CEROID LIPOFUSCINOSES IN NEWBORNS UNIVERSITY OF WASHINGTON (US) 2018-07-26 — — 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 (5 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-20190144916-A1 REAGENTS AND METHODS FOR SCREENING MPS I, II, IIIA, IIIB, IVA, VI, AND VII GAA, MAN2B1, CLN6 BDNF 4504/4885PTN 1621/4885MDK 2814/4885
US-10196668-B2 Reagents and methods for screening MPS I, II, IIIA, IIIB, IVA, VI, and VII GAA, GBA1, MAN2B1 BDNF 2656/4885PTN 1714/4885MDK 1711/4885
US-20180209989-A1 METHODS FOR ASSAYING PALMITOYL PROTEIN THIOESTERASE 1 AND TRIPEPTIDYL PEPTIDASE ACTIVITY IN DRIED BLOOD SPOTS FOR DETECTION OF NEURONAL CEROID LIPOFUSCINOSES IN NEWBORNS PPT1, TPP1, SPTLC1 BDNF 1803/4885PTN 1527/4885MDK 3002/4885
US-20230203082-A1 REAGENTS AND METHODS FOR SCREENING MPS I, II, IIIA, IIIB, IVA, VI, AND VII GAA, MAN2B1, CLN6 BDNF 4504/4885PTN 1621/4885MDK 2814/4885
US-10788499-B2 Methods for assaying palmitoyl protein thioesterase 1 and tripeptidyl peptidase activity in dried blood spots for detection of neuronal ceroid lipofuscinoses in newborns PPT1, TPP1, SPTLC1 BDNF 1803/4885PTN 1527/4885MDK 3002/4885

“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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