Lithium Ion

Lithium Ion

SCHEMBL6713086

Brc1c2nc(c(-c3ccccc3)c3ccc([nH]3)c(Br)c3nc(c(-c4ccccc4)c4ccc1[nH]4)C=C3)C=C2.[Li+].[Li+]

nearest known ligand 0.53

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 7)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 4/20 0.53
▸ STAT3 P40763 1/20 0.52
▸ STAT1 P42224 1/20 0.52
▸ CYCS P99999 3/20 0.51
▸ TERT O14746 4/20 0.50
▸ ENPP2 Q13822 1/20 0.47
▸ ABCG2 Q9UNQ0 1/20 0.41

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
SCHEMBL15943807 0.98 TOP1 (0.54) TOP1STAT3STAT1CYCSTERT
SCHEMBL5011842 0.98 TOP1 (0.54) TOP1STAT3STAT1CYCSTERT
SCHEMBL31550997 0.97 TOP1 (0.53) TOP1STAT3STAT1CYCSTERT
SCHEMBL31550985 0.97 TOP1 (0.53) TOP1STAT3STAT1CYCSTERT
SCHEMBL5137028 0.97 TOP1 (0.53) TOP1STAT3STAT1CYCSTERT
SCHEMBL31551010 0.97 TOP1 (0.53) TOP1STAT3STAT1CYCSTERT
SCHEMBL31550989 0.97 TOP1 (0.53) TOP1STAT3STAT1CYCSTERT
SCHEMBL31550978 0.97 TOP1 (0.53) TOP1STAT3STAT1CYCSTERT
SCHEMBL31550990 0.97 TOP1 (0.53) TOP1STAT3STAT1CYCSTERT
SCHEMBL30136 0.88 TOP1 (0.64) TOP1STAT3STAT1CYCSTERT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040067198-A1 Emissive multichromophoric systems THERIEN MICHAEL J (US) 2004-04-08 — — US disclosed
EP-0656037-B1 METAL-MEDIATED CROSS-COUPLING WITH RING-METALATED PORPHYRINS UNIV PENNSYLVANIA (US) 2003-06-04 — — EP disclosed
EP-1308481-A2 Metal-mediated cross-coupling with ring-metalated porphyrins THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2003-05-07 — — EP disclosed
US-5986090-A Metal-mediated cross-coupling with ring-metalated porphyrins THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1999-11-16 — — US disclosed
US-5756723-A Metal-mediated cross-coupling with ring-metalated porphyrins THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1998-05-26 — — US disclosed
EP-0656037-A4 METAL-MEDIATED CROSS-COUPLING WITH RING-METALATED PORPHYRINS. UNIV PENNSYLVANIA (US) 1997-07-30 — — EP disclosed
US-5493017-A Ring-metalated porphyrins THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1996-02-20 — — US disclosed
EP-0656037-A1 METAL-MEDIATED CROSS-COUPLING WITH RING-METALATED PORPHYRINS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1995-06-07 — — EP disclosed
WO-1994004614-A1 METAL-MEDIATED CROSS-COUPLING WITH RING-METALATED PORPHYRINS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1994-03-03 — — 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-20040067198-A1 Emissive multichromophoric systems MC3R, EML4, TYR TOP1 2833/4885STAT3 2744/4885STAT1 4583/4885

“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.

Send feedback