Choline

Choline

SCHEMBL4184744

C[N+](C)(C)CCO.C[N+](C)(C)CCO.C[N+](C)(C)CCO.O=C([O-])CC(=O)[O-].[Cl-]

nearest known ligand 0.62

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
CYP3A4 P08684 1/20 0.62
SLC5A7 Q9GZV3 1/20 0.62
LMNA P02545 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CA4 P22748 2/20 0.48
GALR3 O60755 1/20 0.38
APEX1 P27695 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CHRM5 P08912 3/20 0.37
CHRM1 P11229 3/20 0.37
CHRM3 P20309 3/20 0.37
BBOX1 O75936 3/20 0.37
BLM P54132 2/20 0.37
POLB P06746 1/20 0.37
ATM Q13315 1/20 0.37
MAPT P10636 1/20 0.37
SLC22A16 Q86VW1 1/20 0.37
CHRM2 P08172 2/20 0.35
CHRM4 P08173 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
Choline SCHEMBL16684846 0.98 MEN1 (0.57) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL780251 0.95 LMNA (0.55) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL16684870 0.95 MEN1 (0.55) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL780252 0.86 LMNA (0.50) CYP3A4SLC5A7LMNAMEN1KMT2A
Succinic Acid SCHEMBL6627654 0.86 CYP3A4 (0.62) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL356672 0.85 MEN1 (0.60) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL119824 0.85 LMNA (0.67) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL16684869 0.85 LMNA (0.48) CYP3A4SLC5A7LMNAMEN1KMT2A
Glycinebetaine SCHEMBL7771556 0.84 CYP3A4 (0.59) CYP3A4SLC5A7LMNAMEN1KMT2A
Choline SCHEMBL8816122 0.83 CYP3A4 (0.65) CYP3A4SLC5A7LMNAMEN1KMT2A

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-20240218101-A1 CURABLE LIQUID/LIQUID/SOLID MULTIPHASIC SUSPENSIONS 3M INNOVATIVE PROPERTIES COMPANY 2024-07-04 US disclosed
WO-2023209105-A1 PROCESS FOR THE RECOVERY OF PLATINUM FROM SPENT PLATINUM-CONTAINING SOLID RESIDUES FUNDACION TECNALIA RESEARCH & INNOVATION (ES) 2023-11-02 WO disclosed
EP-4269635-A1 PROCESS FOR THE RECOVERY OF PLATINUM FROM SPENT PLATINUM-CONTAINING SOLID RESIDUES Fundación Tecnalia Research & Innovation (ES) 2023-11-01 EP disclosed
US-10835999-B2 Solder flux UNIVERSITY OF LEICESTER (GB) 2020-11-17 US disclosed
US-20090247647-A1 Method of Stimulating Proteoglycan Synthesis in Cells NAVY, SECRETARY OF THE UNITED STATES OF AMERICA 2009-10-01 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 (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-20090247647-A1 Method of Stimulating Proteoglycan Synthesis in Cells VDR, CYP2R1, CYP27B1 CYP3A4 3674/4885SLC5A7 2259/4885LMNA 2540/4885

“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.