Choline

Choline

SCHEMBL1933758

CCCCOP(=O)([O-])OCCCC.C[N+](C)(C)CCO

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3GNRHRMPLPDE3APDE3BPDE4APDE4BPDE4CPDE4DPPARASLC5A2

The experimentally established mechanism targets of Choline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 known ✓ P0DMS8 1/20 0.68
LMNA P02545 4/20 0.68
AKT1 P31749 2/20 0.68
ESR1 P03372 1/20 0.68
CDC25A P30304 1/20 0.68
AGTR1 P30556 1/20 0.68
ADRA1A P35348 1/20 0.68
KCNH2 Q12809 1/20 0.68
SMN1; SMN2 Q16637 3/20 0.50
MAPK1 P28482 5/20 0.49
MEN1 O00255 3/20 0.49
GMNN O75496 3/20 0.49
BLM P54132 3/20 0.49
KMT2A Q03164 3/20 0.49
NPSR1 Q6W5P4 3/20 0.49
PRKD3 O94806 1/20 0.49
PRKCG P05129 1/20 0.49
PRKCB P05771 1/20 0.49
PRKCA P17252 1/20 0.49
PRKCH P24723 1/20 0.49

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
Choline SCHEMBL28062058 0.84 LPAR3 (0.58) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL11593283 0.84 LMNA (0.81) LMNAAKT1ESR1ADORA3CDC25A
Cetrimonium SCHEMBL6377382 0.84 LMNA (0.81) LMNAAKT1ESR1ADORA3CDC25A
Phosphoric Acid Monododecyl Ester SCHEMBL28718459 0.83 LMNA (0.64) LMNAAKT1ESR1ADORA3CDC25A
Hexadecyl Dihydrogen Phosphate SCHEMBL1272358 0.83 LMNA (0.64) LMNAAKT1ESR1ADORA3CDC25A
Tetramethylammonium Ion SCHEMBL6553809 0.83 AKT1 (0.67) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL9234856 0.82 LMNA (0.96) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL8679882 0.82 LMNA (0.67) LMNAAKT1ESR1ADORA3CDC25A
Hexadecyl Dihydrogen Phosphate SCHEMBL1272360 0.82 LMNA (0.62) LMNAAKT1ESR1ADORA3CDC25A
SCHEMBL28221734 0.82 AKT1 (0.51) LMNAAKT1ESR1ADORA3CDC25A

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12551441-B2 Water soluble silicon-containing granulate BIO MINERALS NV (BE) 2026-02-17 US claimed
US-20240408130-A1 Combination of Silicon and Magnesium for the Prevention and Treatment of Muscle Cramps BIO MINERALS N.V. (BE) 2024-12-12 US claimed
US-11878031-B2 Silicic acids for use in the treatment of periodontitis BIO MINERALS N.V. (BE) 2024-01-23 US claimed
US-20220008454-A1 Silicic Acids for Use in the Treatment of Periodontitis BIO MINERALS N.V. (BE) 2022-01-13 US claimed
CN-113226328-A Silicic acid for treating periodontitis 生物矿物股份有限公司 2021-08-06 CN claimed
WO-2020070300-A1 SILICIC ACIDS FOR USE IN THE TREATMENT OF PERIODONTITIS BIO MINERALS N.V. (BE) 2020-04-09 WO claimed
EP-3632449-A1 SILICIC ACIDS FOR USE IN THE TREATMENT OF PERIODONTITIS Bio Minerals N.V. (BE) 2020-04-08 EP claimed
US-12551441-B2 Water soluble silicon-containing granulate BIO MINERALS NV (BE) 2026-02-17 US disclosed
US-20240408130-A1 Combination of Silicon and Magnesium for the Prevention and Treatment of Muscle Cramps BIO MINERALS N.V. (BE) 2024-12-12 US disclosed
US-11878031-B2 Silicic acids for use in the treatment of periodontitis BIO MINERALS N.V. (BE) 2024-01-23 US disclosed
US-20220143078-A1 Combination of Silicon and Magnesium for the Prevention and Treatment of Muscle Cramps BIO MINERALS N.V. (BE) 2022-05-12 US disclosed
US-20220008454-A1 Silicic Acids for Use in the Treatment of Periodontitis BIO MINERALS N.V. (BE) 2022-01-13 US disclosed
CN-113853202-A Silicon-magnesium combination for preventing and treating muscle spasm 生物矿物股份有限公司 2021-12-28 CN disclosed
EP-3650532-A1 METHODS, APPARATUS AND KITS FOR BACTERIAL CELL LYSIS Technische Universität Wien (AT) 2020-05-13 EP disclosed
WO-2020070300-A1 SILICIC ACIDS FOR USE IN THE TREATMENT OF PERIODONTITIS BIO MINERALS N.V. (BE) 2020-04-09 WO disclosed
EP-3632449-A1 SILICIC ACIDS FOR USE IN THE TREATMENT OF PERIODONTITIS Bio Minerals N.V. (BE) 2020-04-08 EP disclosed
US-9289381-B2 Stabilization and storage of biological pharmaceutical compositions THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE (US) 2016-03-22 US disclosed
US-20130089912-A1 METHODS AND COMPOSITIONS FOR THE STABILIZATION OF BIOLOGIC MATERIAL THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE 2013-04-11 US disclosed
US-20120230944-A1 STABILIZATION AND STORAGE OF BIOLOGICAL PHARMACEUTICAL COMPOSITIONS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-09-13 US disclosed
WO-2011069037-A2 STABILIZATION AND STORAGE OF BIOLOGICAL PHARMACEUTICAL COMPOSITIONS THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE (US) 2011-06-09 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 (2 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-12551441-B2 Water soluble silicon-containing granulate SI, GIPR, VIP ADORA3 2072/4885LMNA 1265/4885AKT1 3666/4885
US-20120230944-A1 STABILIZATION AND STORAGE OF BIOLOGICAL PHARMACEUTICAL COMPOSITIONS IL2, IL2RA, IL36G ADORA3 4286/4885LMNA 2050/4885AKT1 3510/4885

“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.