Lithium Ion

Lithium Ion

SCHEMBL414030

O=C([O-])CCN1CCN(c2nnc(C(F)(F)F)s2)CC1.[Li+]

nearest known ligand 0.46

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 9)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.46
HTT P42858 2/20 0.44
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 6/20 0.39
KMT2A Q03164 4/20 0.39
LMNA P02545 1/20 0.38
PHGDH O43175 1/20 0.38
LCAT P04180 2/20 0.37
SLC6A9 P48067 7/20 0.37

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 SCHEMBL414299 0.93 ATM (0.44) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL12042000 0.87 HTT (0.48) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL414029 0.86 HTT (0.47) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL414298 0.81 HTT (0.45) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL13447349 0.73 ATM (0.59) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL18711350 0.72 ATM (0.52) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL2119090 0.72 ATM (0.52) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL12059838 0.71 ATM (0.39) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL18702081 0.70 ATM (0.50) ATMHTTALDH1A1MEN1KMT2A
SCHEMBL15025447 0.70 ATM (0.59) ATMHTTALDH1A1MEN1KMT2A

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-9096524-B2 Anthelmintic agents and their use INTERVET INTERNATIONAL B.V. (NL) 2015-08-04 US disclosed
EP-2408742-B1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INT BV (NL) 2014-09-03 EP disclosed
EP-2408742-A1 ANTHELMINTIC AGENTS AND THEIR USE Intervet International B.V. (NL) 2012-01-25 EP disclosed
US-20110319393-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2011-12-29 US disclosed
WO-2010115688-A1 ANTHELMINTIC AGENTS AND THEIR USE INTERVET INTERNATIONAL B.V. (NL) 2010-10-14 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-20110319393-A1 ANTHELMINTIC AGENTS AND THEIR USE ACHE, ABCB11, MPO ATM 4691/4885HTT 156/4885ALDH1A1 864/4885

“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.