SCHEMBL22772375

SCHEMBL22772375

CCCCCCC(CC)C(=O)[O-].CCCCCCC(CC)C(=O)[O-].CCCCCCC(CC)C(=O)[O-].[La+3]

nearest known ligand 0.77

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 7/20 0.77
▸ CA1 P00915 6/20 0.55
▸ NFKB1 P19838 3/20 0.52
▸ CYP3A4 P08684 2/20 0.52
▸ TSHR P16473 2/20 0.52
▸ NPSR1 Q6W5P4 2/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ GPR84 Q9NQS5 4/20 0.47
▸ GRIK1 P39086 1/20 0.46
▸ GRIK2 Q13002 1/20 0.46
▸ FFAR1 O14842 1/20 0.45
▸ MAPT P10636 1/20 0.44

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
SCHEMBL28366820 0.96 CA2 (0.77) CA2CA1NFKB1CYP3A4TSHR
SCHEMBL28957154 0.96 CA2 (0.77) CA2CA1NFKB1CYP3A4TSHR
Lithium Ion SCHEMBL22772374 0.96 CA2 (0.77) CA2CA1NFKB1CYP3A4TSHR
SCHEMBL10944798 0.96 CA2 (0.77) CA2CA1NFKB1CYP3A4TSHR
SCHEMBL5057190 0.96 CA2 (0.77) CA2CA1NFKB1CYP3A4TSHR
SCHEMBL3839235 0.96 CA2 (0.84) CA2CA1NFKB1CYP3A4TSHR
Potassium Ion SCHEMBL15821222 0.96 CA2 (0.77) CA2CA1NFKB1CYP3A4TSHR
SCHEMBL22772366 0.96 CA2 (0.77) CA2CA1NFKB1CYP3A4TSHR
Potassium Ion SCHEMBL28483811 0.96 CA2 (0.77) CA2CA1NFKB1CYP3A4TSHR
SCHEMBL30685115 0.96 CA2 (0.84) CA2CA1NFKB1CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999630-B2 Method of tuning the conversion temperature of cubic phase of aluminum-doped lithium lanthanum zirconium oxide UCHICAGO ARGONNE, LLC (US) 2024-06-04 — — US disclosed
US-20200392014-A1 METHOD OF TUNING THE CONVERSION TEMPERATURE OF CUBIC PHASE OF ALUMINUM-DOPED LITHIUM LANTHANUM ZIRCONIUM OXIDE UCHICAGO ARGONNE, LLC (US) 2020-12-17 — — US disclosed
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