Lithium Ion

Lithium Ion

SCHEMBL3308570

O=C([O-])c1cc2ncccc2s1.[Li+]

nearest known ligand 0.51

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
GRIN3B O60391 1/20 0.51
GRIN1 Q05586 1/20 0.51
GRIN2C Q14957 1/20 0.51
NAMPT P43490 1/20 0.49
ALOX5 P09917 1/20 0.45
LIMK1 P53667 1/20 0.36
ALDH1A1 P00352 3/20 0.36
CASP3 P42574 2/20 0.35
SENP8 Q96LD8 2/20 0.35
SENP7 Q9BQF6 2/20 0.35
SENP6 Q9GZR1 2/20 0.35
TMIGD3 P0DMS9 1/20 0.35
ADORA1 P30542 1/20 0.35
STAT1 P42224 1/20 0.35
BCL2L1 Q07817 1/20 0.35
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 2/20 0.34
P4HTM Q9NXG6 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL843784 0.83 GRIN3B (0.57) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL29365840 0.83 GRIN3B (0.57) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL10650333 0.81 GRIN3B (0.52) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL3308576 0.81 GRIN3B (0.56) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL31108975 0.81 GRIN3B (0.56) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL1217553 0.81 GRIN3B (0.56) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL843685 0.78 GRIN3B (0.52) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL5775228 0.78 GRIN3B (0.49) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL29368089 0.78 GRIN3B (0.52) GRIN3BGRIN1GRIN2CNAMPTALOX5
SCHEMBL5776214 0.78 GRIN3B (0.59) GRIN3BGRIN1GRIN2CNAMPTALOX5

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
EP-1577301-B1 Antithrombotic diaminocyclohexane derivatives DAIICHI SANKYO CO LTD (JP) 2012-09-12 EP disclosed
US-20100099660-A1 METHOD FOR TREATING THROMBOSIS OR EMBOLISM AND RELATED DISEASES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2010-04-22 US disclosed
US-20090281074-A1 DRUG COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING THROMBOSIS OR EMBOLISM DAIICHI PHARMACEUTICAL CO., LTD (JP) 2009-11-12 US disclosed
US-7576135-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-08-18 US disclosed
US-7342014-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-11 US disclosed
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-11-09 US disclosed
EP-1577301-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP disclosed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP 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 (4 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-20100099660-A1 METHOD FOR TREATING THROMBOSIS OR EMBOLISM AND RELATED DISEASES F2, PLAT, MPL GRIN3B 1504/4885GRIN1 786/4885GRIN2C 1759/4885
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X F2, C1S, C9 GRIN3B 2181/4885GRIN1 852/4885GRIN2C 2293/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R GRIN3B 2025/4885GRIN1 829/4885GRIN2C 1979/4885
US-20090281074-A1 DRUG COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING THROMBOSIS OR EMBOLISM C1R, C9, F2 GRIN3B 790/4885GRIN1 229/4885GRIN2C 408/4885

“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.