Lithium Ion

Lithium Ion

SCHEMBL1765032

CCOC(=O)C(=O)/C=C(/[O-])c1ccc(F)c(Cl)c1.[Li+]

nearest known ligand 0.38

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 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.38
TSHR P16473 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
LMNA P02545 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CASP3 P42574 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
TAS1R3 Q7RTX0 2/20 0.36
TAS1R1 Q7RTX1 2/20 0.36
TAS1R2 Q8TE23 2/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ABCB1 P08183 1/20 0.35
ALDH1A1 P00352 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
Lithium Ion SCHEMBL1765035 1.00 EGFR (0.38) EGFRTSHRL3MBTL1MAPTSMN1; SMN2
Lithium Ion SCHEMBL1765077 0.88 ALDH1A1 (0.41) TSHRL3MBTL1MAPTLMNAMEN1
Lithium Ion SCHEMBL1765076 0.88 ALDH1A1 (0.41) TSHRL3MBTL1MAPTLMNAMEN1
Lithium Ion SCHEMBL1764887 0.85 KDM4E (0.38) TSHRMAPTSMN1; SMN2LMNAMEN1
Lithium Ion SCHEMBL1764888 0.85 KDM4E (0.38) TSHRMAPTSMN1; SMN2LMNAMEN1
SCHEMBL12596944 0.85 MAPT (0.43) EGFRTSHRL3MBTL1MAPTSMN1; SMN2
Lithium Ion SCHEMBL17163917 0.84 SMN1; SMN2 (0.46) TSHRMAPTSMN1; SMN2LMNATDP1
SCHEMBL1765036 0.84 MAPT (0.43) EGFRTSHRL3MBTL1MAPTSMN1; SMN2
Lithium Ion SCHEMBL1765532 0.83 KCNN4 (0.39) L3MBTL1MAPTLMNAMEN1KMT2A
Lithium Ion SCHEMBL1765534 0.83 KCNN4 (0.39) L3MBTL1MAPTLMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399682-B2 Substituted (pyrazolylcarbonyl)imidazolidinones and their use AICURIS GMBH & CO. KG (DE) 2013-03-19 US disclosed
US-20110124618-A1 SUBSTITUTED (PYRAZOLYLCARBONYL)IMIDAZOLIDINONES AND THEIR USE AICURIS GMBH & CO. KG (DE) 2011-05-26 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 (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-20110124618-A1 SUBSTITUTED (PYRAZOLYLCARBONYL)IMIDAZOLIDINONES AND THEIR USE TPMT, PAICS, THPO EGFR 4260/4885TSHR 3942/4885L3MBTL1 1446/4885

“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.