Lithium Ion

Lithium Ion

SCHEMBL941066

COc1cc(OC)nc(NC(=O)[N-]S(=O)(=O)c2ncccc2C2=NOCCO2)n1.[Li+]

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

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

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
TP53 P04637 1/20 0.36
GLA P06280 1/20 0.36
CYP1A2 P05177 1/20 0.34
KMT2A Q03164 1/20 0.34
GAA P10253 1/20 0.33
CASR P41180 1/20 0.33
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 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
Potassium Ion SCHEMBL940666 0.98 MAPT (0.36) MAPTTP53GLACYP1A2KMT2A
SCHEMBL939298 0.98 MAPT (0.36) MAPTTP53GLACYP1A2KMT2A
Choline SCHEMBL972000 0.91 MAPT (0.35) MAPTTP53GLACYP1A2KMT2A
SCHEMBL971125 0.91 MAPT (0.35) MAPTTP53GLAKMT2AGAA
Acetylcholine SCHEMBL970813 0.89 TP53 (0.33) MAPTTP53GLACYP1A2CASR
SCHEMBL939859 0.84 GAA (0.47) MAPTTP53GLACYP1A2KMT2A
Ammonia Solution, Strong SCHEMBL939852 0.83 GAA (0.46) MAPTTP53GLACYP1A2KMT2A
SCHEMBL1576599 0.83 MAPT (0.35) MAPTTP53GLACYP1A2KMT2A
SCHEMBL19034725 0.82 MAPT (0.36) MAPTTP53GLACYP1A2KMT2A
SCHEMBL15244182 0.81 GAA (0.42) MAPTTP53GLAKMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110009263-A1 SELECTED SALTS OF 3-(5,6-DIHYDRO-1,4,2-DIOXAZIN-3-YL)-N-[(4,6-DIMETHOXYPYRIMIDIN-2-YL)CARBAMOYL]PYRIDINE-2-SULFONAMIDE, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2011-01-13 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-20110009263-A1 SELECTED SALTS OF 3-(5,6-DIHYDRO-1,4,2-DIOXAZIN-3-YL)-N-[(4,6-DIMETHOXYPYRIMIDIN-2-YL)CARBAMOYL]PYRIDINE-2-SULFONAMIDE, METHOD FOR THE PRODUCTION THEREOF, AND USE THEREOF AS HERBICIDES AND PLANT GROWTH REGULATORS DDT, DYRK4, SLTM MAPT 3826/4885TP53 3307/4885GLA 2366/4885

“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.