SCHEMBL4101035

SCHEMBL4101035

NCC[O-].NCC[O-].[Ba+2]

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
Zinc Ion SCHEMBL3729737 0.89
SCHEMBL10437279 0.89 NFKB1 (0.33)
Lithium Ion SCHEMBL9744318 0.89 NFKB1 (0.33)
SCHEMBL10437277 0.89 NFKB1 (0.33)
SCHEMBL6013267 0.89
SCHEMBL4266068 0.89
Potassium Ion SCHEMBL7593831 0.89
SCHEMBL17101817 0.77 DNM1 (0.32)
SCHEMBL17959501 0.67 NFKB1 (0.46)
SCHEMBL2586988 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090168299-A1 METHOD FOR THE PRODUCTION OF A COATING OF A POROUS, ELECTRICALLY CONDUCTIVE SUPPORT MATERIAL WITH A DIELECTRIC, AND PRODUCTION OF CAPACITORS HAVING HIGH CAPACITY DENSITY WITH THE AID OF SAID METHOD BASF SE (DE) 2009-07-02 US disclosed