SCHEMBL29935478

SCHEMBL29935478

N#Cc1c(C#N)c(C#N)c2[nH]c(C(F)(F)C(F)(F)F)nc2c1C#N

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.33
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HIF1A Q16665 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
Lithium Ion SCHEMBL29941941 0.98 CSNK2A1 (0.32) CSNK2A1CSNK2A2CSNK2BKDM4EALDH1A1
SCHEMBL28847038 0.98 CSNK2A1 (0.32) CSNK2A1CSNK2A2CSNK2BKDM4EALDH1A1
Lithium SCHEMBL30899070 0.98 CSNK2A1 (0.32) CSNK2A1CSNK2A2CSNK2BKDM4EALDH1A1
SCHEMBL29935720 0.86 CSNK2A1 (0.46) CSNK2A1CSNK2A2CSNK2BKDM4EALDH1A1
SCHEMBL28847057 0.84 CSNK2A1 (0.44) CSNK2A1CSNK2A2CSNK2BKDM4EHPGD
Lithium Ion SCHEMBL29942094 0.84 CSNK2A1 (0.44) CSNK2A1CSNK2A2CSNK2BKDM4EHPGD
Lithium SCHEMBL30979616 0.84 CSNK2A1 (0.44) CSNK2A1CSNK2A2CSNK2BKDM4EHPGD
SCHEMBL29935376 0.73 AR (0.32) CSNK2A1CSNK2A2CSNK2B
Lithium SCHEMBL30899072 0.72 AR (0.31) CSNK2A1CSNK2A2CSNK2B
Lithium Ion SCHEMBL29942207 0.72 AR (0.33) CSNK2A1CSNK2A2CSNK2B

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
EP-4060770-A1 BATTERY CELL, ELECTROLYTE MIXTURE AND USE OF AN ELECTROLYTE MIXTURE VOLKSWAGEN AG (DE) 2022-09-21 EP claimed
EP-4060770-A1 BATTERY CELL, ELECTROLYTE MIXTURE AND USE OF AN ELECTROLYTE MIXTURE VOLKSWAGEN AG (DE) 2022-09-21 EP disclosed