SCHEMBL29935720

SCHEMBL29935720

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

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.46
CSNK2A2 P19784 1/20 0.46
CSNK2B P67870 1/20 0.46
MAPT P10636 2/20 0.40
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PARP1 P09874 1/20 0.33
KDM4E B2RXH2 2/20 0.31
HPGD P15428 2/20 0.31
USP2 O75604 1/20 0.31
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
GLA P06280 1/20 0.30

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
SCHEMBL28847057 0.98 CSNK2A1 (0.44) CSNK2A1CSNK2A2CSNK2BMAPTGAA
Lithium Ion SCHEMBL29942094 0.98 CSNK2A1 (0.44) CSNK2A1CSNK2A2CSNK2BMAPTGAA
Lithium SCHEMBL30979616 0.98 CSNK2A1 (0.44) CSNK2A1CSNK2A2CSNK2BMAPTGAA
SCHEMBL29935478 0.86 CSNK2A1 (0.33) CSNK2A1CSNK2A2CSNK2BKDM4EHPGD
SCHEMBL28847038 0.84 CSNK2A1 (0.32) CSNK2A1CSNK2A2CSNK2BKDM4EHPGD
Lithium SCHEMBL30899070 0.84 CSNK2A1 (0.32) CSNK2A1CSNK2A2CSNK2BKDM4EHPGD
Lithium Ion SCHEMBL29941941 0.84 CSNK2A1 (0.32) CSNK2A1CSNK2A2CSNK2BKDM4EHPGD
SCHEMBL29935622 0.71 CSNK2A1 (0.43) CSNK2A1CSNK2A2CSNK2BMAPTGAA
Lithium SCHEMBL31689783 0.71 PSMB8 (0.37)
Lithium Ion SCHEMBL29942631 0.71 PSMB8 (0.37)

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