SCHEMBL23027200

SCHEMBL23027200

C=C(C)c1c(F)c(F)c(F)c2c1C(=O)N([C@@H](C)C(=O)O)C2=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.47
CSNK2B P67870 1/20 0.47
CSNK2A1 P68400 1/20 0.47
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 1/20 0.37
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 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
SCHEMBL23027307 0.86 CSNK2A2 (0.61) CSNK2A2CSNK2BCSNK2A1KDM4EHSD17B10
SCHEMBL23027286 0.69 CSNK2A2 (0.41) CSNK2A2CSNK2BCSNK2A1KDM4EKMT2A
SCHEMBL24489348 0.69 CSNK2A2 (0.41) CSNK2A2CSNK2BCSNK2A1KDM4EKMT2A
SCHEMBL29697484 0.65 CSNK2A2 (0.36) CSNK2A2CSNK2BCSNK2A1PDE4APDE4B
SCHEMBL646711 0.62 TYMP (0.31)
SCHEMBL23027209 0.60 CSNK2A2 (0.32) CSNK2A2CSNK2BCSNK2A1PDE4APDE4B
SCHEMBL24489465 0.60 CSNK2A2 (0.32) CSNK2A2CSNK2BCSNK2A1PDE4APDE4B
SCHEMBL27937656 0.59 MEN1 (0.40) KMT2AMEN1GAA
SCHEMBL6926420 0.58 ALDH1A1 (0.44) CSNK2BCSNK2A1
SCHEMBL125972 0.58 LMNA (0.71) KDM4EHSD17B10KMT2AGAACASP1

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
WO-2021033649-A1 PRODUCTION METHOD FOR NITROGEN-CONTAINING FLUORINE-CONTAINING COMPOUND AGC株式会社 2021-02-25 WO disclosed