Lithium Ion

Lithium Ion

SCHEMBL7034813

CCOc1ccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)c(C(=O)[O-])c2)cc1.[Li+]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 1.00
PPARA Q07869 7/20 0.68
MEN1 O00255 1/20 0.56
POLB P06746 1/20 0.56
KMT2A Q03164 1/20 0.56
TP53 P04637 1/20 0.54
TAS1R3 Q7RTX0 1/20 0.50
TAS1R1 Q7RTX1 1/20 0.50
NPC1 O15118 1/20 0.50
HDAC1 Q13547 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 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
SCHEMBL7040832 0.90 PPARG (0.81) PPARGPPARAMEN1POLBKMT2A
SCHEMBL7034817 0.89 PPARG (0.80) PPARGPPARAMEN1POLBKMT2A
SCHEMBL7034829 0.89 PPARG (0.80) PPARGPPARAMEN1POLBKMT2A
Lithium Ion SCHEMBL7041189 0.87 PPARG (0.77) PPARGPPARA
Lithium Ion SCHEMBL7038553 0.83 PPARG (0.72) PPARGPPARAMEN1POLBKMT2A
Lithium Ion SCHEMBL7041701 0.83 PPARG (0.71) PPARGPPARAMEN1POLBKMT2A
Lithium Ion SCHEMBL7039324 0.83 PPARG (0.84) PPARGPPARAMEN1POLBKMT2A
Lithium Ion SCHEMBL7151915 0.82 PPARG (0.69) PPARGPPARATP53NPC1
Lithium Ion SCHEMBL7038128 0.82 PPARG (0.69) PPARGPPARA
Lithium Ion SCHEMBL7040492 0.81 PPARG (1.00) PPARGPPARAMEN1POLBKMT2A

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-20030073862-A1 Compounds BIOVITRUM AB (SE) 2003-04-17 US disclosed
WO-2003004458-A1 NEW COMPOUNDS BIOVITRUM AB (SE) 2003-01-16 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 (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-20030073862-A1 Compounds PPARG, PPARA, PPARD PPARG 1/4885PPARA 2/4885MEN1 4333/4885

“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.