SCHEMBL19655870

SCHEMBL19655870

CC(=O)/C=C(\N(C)C(=O)Nc1nc(Oc2ccccc2OCc2ccccc2)c(Cl)cc1F)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPIA P62937 6/20 0.35
BRD4 O60885 4/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP19A1 P11511 2/20 0.34
EZH2 Q15910 1/20 0.34
PPIF P30405 1/20 0.34
PTGER1 P34995 1/20 0.34
NPC1 O15118 1/20 0.33

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
SCHEMBL19655799 0.85 DHODH (0.31) MAPT
SCHEMBL19655872 0.79 KMT2A (0.34) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL19641805 0.77 PTGER1 (0.46) PPIABRD4KDM4EMEN1MAPT
SCHEMBL19827967 0.76 LMNA (0.35) MEN1MAPTKMT2ASMN1; SMN2
SCHEMBL19655849 0.75 PPIA (0.40) PPIABRD4SMN1; SMN2PPIFPTGER1
SCHEMBL21033435 0.70 MAPT (0.40) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL19655811 0.69 HTT (0.49) BRD4KDM4EMAPTSMN1; SMN2PTGER1
SCHEMBL29435259 0.68 LTA4H (0.46) MAPTSMN1; SMN2NPC1
SCHEMBL19641833 0.68 LTA4H (0.46) MAPTSMN1; SMN2NPC1
SCHEMBL22789719 0.66 TSHR (0.48) KDM4EMEN1MAPTKMT2ASMN1; SMN2

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