SCHEMBL21924176

SCHEMBL21924176

C=C(C)C(=O)OCC[N+](C)(C)CCCCC(=O)[O-]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 8/20 0.45
TSHR P16473 3/20 0.42
THRB P10828 1/20 0.40
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
MAPT P10636 1/20 0.36
BLM P54132 1/20 0.36
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ADRA2A P08913 1/20 0.33
ADRA1A P35348 1/20 0.33
GALR3 O60755 1/20 0.33
PGR P06401 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
HTR1A P08908 1/20 0.33
CHRNB2 P17787 1/20 0.33

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
SCHEMBL21924148 0.95 BBOX1 (0.50) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL16798956 0.94 TSHR (0.46) BBOX1TSHRTHRBMAPTBLM
SCHEMBL16798877 0.93 TSHR (0.49) BBOX1TSHRTHRBPOLBAPEX1
SCHEMBL16798858 0.93 TSHR (0.49) BBOX1TSHRTHRBPOLBAPEX1
SCHEMBL16799486 0.93 TSHR (0.49) BBOX1TSHRTHRBPOLBAPEX1
SCHEMBL16798885 0.93 TSHR (0.49) BBOX1TSHRTHRBPOLBAPEX1
SCHEMBL16798945 0.93 TSHR (0.49) BBOX1TSHRTHRBPOLBAPEX1
SCHEMBL16798857 0.91 TSHR (0.50) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL16798908 0.90 TSHR (0.53) BBOX1TSHRTHRBMAPTBLM
SCHEMBL16799082 0.90 TSHR (0.53) BBOX1TSHRTHRBMAPTBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545747-B2 Method, kit, and device for preparing glycan from glycoprotein NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2026-02-10 US disclosed
WO-2025070814-A1 SUGAR CHAIN PREPARATION METHOD AND SUGAR CHAIN ANALYSIS METHOD 住友ベークライト株式会社 2025-04-03 WO disclosed
EP-3896074-B1 METHOD, KIT, AND DEVICE FOR PREPARING GLYCAN FROM GLYCOPROTEIN AIST (JP) 2023-10-25 EP disclosed
US-20220017648-A1 Method, Kit, and Device for Preparing Glycan from Glycoprotein SUMITOMO BAKELITE CO., LTD. (JP) 2022-01-20 US disclosed
EP-3896074-A1 METHOD, KIT, AND DEVICE FOR PREPARING GLYCAN FROM GLYCOPROTEIN NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2021-10-20 EP disclosed
US-11136344-B2 Purification agent for sugar chain or glycopeptide, and use thereof SUMITOMO BAKELITE CO., LTD. (JP) 2021-10-05 US disclosed
US-20200216484-A1 PURIFICATION AGENT FOR SUGAR CHAIN OR GLYCOPEPTIDE, AND USE THEREOF SUMITOMO BAKELITE CO., LTD. (JP) 2020-07-09 US disclosed
WO-2020122072-A1 METHOD, KIT, AND DEVICE FOR PREPARING GLYCAN FROM GLYCOPROTEIN 国立研究開発法人産業技術総合研究所 2020-06-18 WO disclosed
EP-3650456-A1 PURIFICATION AGENT FOR SUGAR CHAIN OR GLYCOPEPTIDE, AND USE THEREOF Sumitomo Bakelite Co., Ltd. (JP) 2020-05-13 EP 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 (3 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-20200216484-A1 PURIFICATION AGENT FOR SUGAR CHAIN OR GLYCOPEPTIDE, AND USE THEREOF FUT5, MANBA, MGAM BBOX1 227/4885TSHR 2497/4885THRB 711/4885
US-11136344-B2 Purification agent for sugar chain or glycopeptide, and use thereof FUT5, MANBA, MGAM BBOX1 227/4885TSHR 2497/4885THRB 711/4885
US-12545747-B2 Method, kit, and device for preparing glycan from glycoprotein FUT7, FUT4, SIGLEC7 BBOX1 790/4885TSHR 565/4885THRB 388/4885

“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.