SCHEMBL8960113

SCHEMBL8960113

CCc1c(C(F)(F)F)ncn(-c2cc3c(cc2F)OCC(=O)N3)c1=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 13/20 0.41
PARP1 P09874 1/20 0.39
PGR P06401 5/20 0.36
NR3C1 P04150 4/20 0.36
HTR1A P08908 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
SLC6A4 P31645 1/20 0.35
POLB P06746 1/20 0.35
KDM5B Q9UGL1 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
MMP12 P39900 1/20 0.34

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
SCHEMBL8960181 0.85 NR3C2 (0.39) NR3C2PGRNR3C1POLBTP53
SCHEMBL8960197 0.73 MAPK11 (0.40) KDM5B
SCHEMBL9603358 0.70 KIF11 (0.47) NR3C2PGRNR3C1POLBMMP12
SCHEMBL7563867 0.68 NR3C2 (0.39) NR3C2PGRNR3C1HTR1AHTR1D
SCHEMBL7556723 0.68 MMP12 (0.46) NR3C2PARP1PGRNR3C1HTR1A
SCHEMBL8177519 0.67 NR3C2 (0.41) NR3C2PGRNR3C1POLBTP53
SCHEMBL10592084 0.66 NR3C2 (0.53) NR3C2PGRNR3C1HTR1AHTR1D
SCHEMBL4049030 0.66 MMP12 (0.54) NR3C2PARP1PGRTP53MAPT
SCHEMBL12808579 0.66 MMP12 (0.41) NR3C2PARP1PGRNR3C1HTR1A
SCHEMBL10609355 0.65 NR3C2 (0.43) NR3C2PARP1PGRNR3C1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532208-A HERBICIDES SUMITOMO CHEMICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5366955-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-11-22 US disclosed
EP-0568041-A1 Pyrimidone derivatives and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-03 EP disclosed