SCHEMBL24917757

SCHEMBL24917757

O=C(O)C(F)(F)c1cccc(C(F)(F)F)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.50
TAS2R14 Q9NYV8 2/20 0.46
PGK1 P00558 1/20 0.46
PGK2 P07205 1/20 0.46
AHR P35869 1/20 0.41
JAK2 O60674 1/20 0.38
NOTUM Q6P988 1/20 0.38
ACLY P53396 1/20 0.37
ADRB1 P08588 1/20 0.37
CES2 O00748 1/20 0.37
LMNA P02545 1/20 0.37
IDH1 O75874 1/20 0.37
IDH2 P48735 1/20 0.37
SYK P43405 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
KAT6A Q92794 1/20 0.36
CNR2 P34972 1/20 0.36
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL30528019 1.00 P2RX7 (0.50) P2RX7TAS2R14PGK1PGK2AHR
SCHEMBL25306752 0.82 PGK1 (0.40) P2RX7TAS2R14PGK1PGK2AHR
SCHEMBL11395905 0.81 TSHR (0.57) P2RX7TAS2R14PGK1PGK2LMNA
SCHEMBL1759639 0.81 PGK1 (0.39) P2RX7TAS2R14PGK1PGK2AHR
SCHEMBL30527948 0.81 PGK1 (0.39) P2RX7TAS2R14PGK1PGK2AHR
SCHEMBL31216648 0.81 P2RX7 (0.47) P2RX7TAS2R14PGK1PGK2AHR
SCHEMBL3295150 0.80 P2RX7 (0.50) P2RX7TAS2R14PGK1PGK2AHR
SCHEMBL24917508 0.77 PGK1 (0.36) P2RX7TAS2R14PGK1PGK2KDM4E
SCHEMBL25305047 0.77 CTSS (0.41) P2RX7PGK1PGK2AHRCES1
SCHEMBL24917504 0.77 P2RX7 (0.37) P2RX7TAS2R14PGK1PGK2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO disclosed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO disclosed
WO-2023286057-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD (IL) 2023-01-19 WO disclosed