Lithium Ion

Lithium Ion

SCHEMBL1765007

CCOC(=O)C(=O)/C=C(/[O-])c1cc(F)cc(F)c1.[Li+]

nearest known ligand 0.40

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
MAPT P10636 5/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
LMNA P02545 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
XPO1 O14980 1/20 0.36
CHRM1 P11229 2/20 0.36
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 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
Lithium Ion SCHEMBL1765009 1.00 MAPT (0.40) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1764995 0.93 MAPT (0.38) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1764993 0.93 MAPT (0.38) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1765052 0.92 GPR35 (0.38) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1765051 0.92 GPR35 (0.38) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1526231 0.91 XPO1 (0.39) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1160697 0.91 XPO1 (0.39) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1765312 0.90 SMN1; SMN2 (0.39) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1765310 0.90 SMN1; SMN2 (0.39) MAPTMEN1KMT2ALMNANPSR1
Lithium Ion SCHEMBL1764989 0.88 GPR35 (0.41) MAPTMEN1KMT2ALMNANPSR1

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 MAPT 2876/4885MEN1 2360/4885KMT2A 1193/4885

“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.