SCHEMBL19655872

SCHEMBL19655872

CC(=O)/C=C(\N(C)C(=O)Nc1nc(Oc2ccccc2O)c(F)cc1F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PNLIP P16233 1/20 0.32
DHODH Q02127 2/20 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
SCHEMBL19655851 0.92 DHODH (0.33) KMT2AMEN1MAPK1SMN1; SMN2KDM4E
SCHEMBL19655853 0.80 LMNA (0.33) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL19655911 0.79
SCHEMBL19655870 0.79 PPIA (0.35) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL19655813 0.76 DHODH (0.33) KMT2AMEN1SMN1; SMN2MAPTDHODH
SCHEMBL19827967 0.66 LMNA (0.35) KMT2AMEN1MAPK1SMN1; SMN2MAPT
SCHEMBL19827988 0.65 P2RY1 (0.35) KMT2AMEN1KDM4EMAPTDHODH
SCHEMBL25098139 0.60
SCHEMBL21033435 0.57 MAPT (0.40) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL28479796 0.55 POLB (0.43) KMT2AMAPK1SMN1; SMN2GAA

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-2017202768-A1 HERBICIDAL URACILPYRID BASF SE (DE) 2017-11-30 WO disclosed