SCHEMBL22804207

SCHEMBL22804207

O=C(O)CNC(=O)c1ccc(F)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.59
KDM4E B2RXH2 3/20 0.53
MAPT P10636 1/20 0.53
HIF1A Q16665 1/20 0.53
SLC22A6 Q4U2R8 1/20 0.53
SLC22A8 Q8TCC7 1/20 0.53
FOLH1 Q04609 4/20 0.51
ATM Q13315 1/20 0.49
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
HPGDS O60760 1/20 0.46
EGLN1 Q9GZT9 2/20 0.45
MAPK1 P28482 1/20 0.44
DGAT1 O75907 1/20 0.44
PTPRC P08575 2/20 0.43
CTSL P07711 1/20 0.43
PTPN13 Q12923 1/20 0.43
KCNQ3 O43525 1/20 0.43
KCNQ2 O43526 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL30449451 1.00 EPHX2 (0.59) EPHX2KDM4EMAPTHIF1ASLC22A6
SCHEMBL19835593 0.80 EPHX2 (0.63) EPHX2KDM4EFOLH1CA1CA2
SCHEMBL3955664 0.79 EPHX2 (0.54) EPHX2KDM4EMAPTHIF1AFOLH1
SCHEMBL11107537 0.78 KDM4E (0.80) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL16560318 0.78 KDM4E (0.50) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL30450105 0.77 KDM4E (0.67) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL1742166 0.77 KDM4E (0.67) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL30226503 0.76 KDM1A (0.57) EPHX2
SCHEMBL19983089 0.75 BAZ2B (0.56) EPHX2MAPTKCNQ3KCNQ2
SCHEMBL21531028 0.75 EPHX2 (0.58) EPHX2KDM4EFOLH1EGLN1

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-2020253824-A1 18F-LABELED FLUOROPICOLINYLGLYCINE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 山西医科大学第一医院 2020-12-24 WO disclosed