SCHEMBL147227

SCHEMBL147227

CC(=O)c1ccnnn1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL10881740 0.79 ALDH1A1 (0.31)
SCHEMBL31671034 0.77
SCHEMBL28654253 0.77 NAPRT (0.40)
SCHEMBL28442642 0.77 FAAH (0.35)
SCHEMBL27561490 0.77 MAPK1 (0.43)
Lithium Ion SCHEMBL28674518 0.76 HIPK2 (0.31)
Bromide SCHEMBL27792171 0.76 NNMT (0.42)
SCHEMBL31519524 0.76 NNMT (0.42)
Hydrochloric Acid SCHEMBL27792154 0.76 NNMT (0.42)
SCHEMBL13165482 0.75 KCNJ1 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1317013-B1 NON-AQUEOUS ELECTROLYTE AND SECONDARY CELL USING THE SAME MITSUBISHI CHEM CORP (JP) 2017-03-15 EP disclosed
US-9293768-B2 Battery electrode, method of producing the same, nonaqueous electrolyte battery, battery pack, and active material KABUSHIKI KAISHA TOSHIBA (JP) 2016-03-22 US disclosed
US-20120058395-A1 BATTERY ELECTRODE, METHOD OF PRODUCING THE SAME, NONAQUEOUS ELECTROLYTE BATTERY, BATTERY PACK, AND ACTIVE MATERIAL KABUSHIKI KAISHA TOSHIBA (JP) 2012-03-08 US disclosed
US-6942948-B2 Nonaqueous electrolyte solution and secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2005-09-13 US disclosed
US-20030165733-A1 Nonaqueous electrolyte solution and secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2003-09-04 US disclosed
EP-1317013-A1 NON-AQUEOUS ELECTROLYTE AND SECONDARY CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2003-06-04 EP disclosed