SCHEMBL24993294

SCHEMBL24993294

CC(=O)c1cc(C)c(F)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.42
MAPT P10636 4/20 0.42
DAO P14920 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPK14 Q16539 1/20 0.41
CLK1 P49759 1/20 0.39
DYRK1A Q13627 1/20 0.39
DYRK1B Q9Y463 1/20 0.39
GAA P10253 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PNMT P11086 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 2/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL16610035 0.80 CLK1 (0.40) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL24993291 0.78 DAO (0.33) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL5850753 0.77 MAPT (0.68) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL5919500 0.74 MAPT (0.42) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL45690 0.74 MAPT (0.42) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL24578032 0.74 MAPT (0.42) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL10859551 0.74 DAO (0.70) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL16334956 0.72 DAO (0.50) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL13503044 0.71 KDM4E (0.69) KDM4EMAPTDAOALDH1A1MEN1
SCHEMBL31612455 0.71 MAPT (0.39) KDM4EMAPTDAOALDH1A1MEN1

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-2023012821-A1 A PROCESS FOR THE PREPARATION OF CARBAMOYL BENZAMIDE PHENYL ISOXAZOLINE CLASS DRUG/S AND ITS INTERMEDIATES ZENFOLD SUSTAINABLE TECHNOLOGIES PRIVATE LIMITED (IN) 2023-02-09 WO disclosed