SCHEMBL7010249

SCHEMBL7010249

Cn1c(C(F)(F)F)c(-c2cc(O)c(C#N)cc2F)c(=O)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
AR P10275 6/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
BCAT2 O15382 5/20 0.32
BCAT1 P54687 5/20 0.32
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TP53 P04637 1/20 0.30
GLA P06280 1/20 0.30
HPGD P15428 1/20 0.30
PGR P06401 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
SCHEMBL8906963 0.90 L3MBTL1 (0.36) KMT2AMEN1ARL3MBTL1GAA
SCHEMBL6984955 0.87 BCAT2 (0.36) KMT2AMEN1L3MBTL1GAASMN1; SMN2
SCHEMBL8594988 0.86 L3MBTL1 (0.34) KMT2AMEN1L3MBTL1GAASMN1; SMN2
SCHEMBL8381949 0.86 L3MBTL1 (0.34) KMT2AMEN1L3MBTL1GAASMN1; SMN2
SCHEMBL7030310 0.84 L3MBTL1 (0.40) ARL3MBTL1GAABCAT2BCAT1
SCHEMBL7499497 0.84 L3MBTL1 (0.33) KMT2AMEN1L3MBTL1GAASMN1; SMN2
SCHEMBL8541763 0.84 GAA (0.34) KMT2AMEN1ARL3MBTL1GAA
SCHEMBL6987528 0.84 SMN1; SMN2 (0.32) KMT2AMEN1L3MBTL1GAASMN1; SMN2
SCHEMBL8560520 0.82 MEN1 (0.34) KMT2AMEN1ARL3MBTL1GAA
SCHEMBL7030894 0.82 BCAT2 (0.35) KMT2AMEN1L3MBTL1SMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1272478-A1 SUBSTITUTED PHENYLURACILS Bayer Aktiengesellschaft (DE) 2003-01-08 EP disclosed
WO-2001077084-A1 SUBSTITUTED PHENYLURACILS BAYER CROPSCIENCE AG (DE) 2001-10-18 WO disclosed