SCHEMBL24917508

SCHEMBL24917508

C=Nc1cccc(C(F)(F)C(=O)O)n1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
P2RX7 Q99572 1/20 0.34
TAS2R14 Q9NYV8 1/20 0.33
KDM4E B2RXH2 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
ACMSD Q8TDX5 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL24724863 0.78 P2RX7 (0.40) PGK1PGK2P2RX7TAS2R14
SCHEMBL30528019 0.77 P2RX7 (0.50) PGK1PGK2P2RX7TAS2R14KDM4E
SCHEMBL24917757 0.77 P2RX7 (0.50) PGK1PGK2P2RX7TAS2R14KDM4E
SCHEMBL25306752 0.75 PGK1 (0.40) PGK1PGK2P2RX7TAS2R14KDM4E
SCHEMBL1759639 0.74 PGK1 (0.39) PGK1PGK2P2RX7TAS2R14KDM4E
SCHEMBL11395905 0.74 TSHR (0.57) PGK1PGK2P2RX7TAS2R14KDM4E
SCHEMBL30527948 0.74 PGK1 (0.39) PGK1PGK2P2RX7TAS2R14KDM4E
SCHEMBL25305047 0.70 CTSS (0.41) PGK1PGK2P2RX7
SCHEMBL24917504 0.70 P2RX7 (0.37) PGK1PGK2P2RX7TAS2R14KDM4E
SCHEMBL4619117 0.69 SORT1 (0.41) PGK1PGK2KDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN claimed
WO-2023131951-A1 NOVEL DERIVATIVES OF NON-CODED AMINO ACIDS AND THEIR USE AS HERBICIDES FORTEPHEST LTD. (IL) 2023-07-13 WO claimed
CN-118647270-A Novel derivatives of non-coding amino acids and their use as herbicides 福提费斯特有限公司 2024-09-13 CN 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