SCHEMBL8569766

SCHEMBL8569766

Cn1nc(-c2ccc(Cl)cc2F)c(Cl)c1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.47
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
SLC34A1 Q06495 2/20 0.37
EGLN2 Q96KS0 1/20 0.35
PDE2A O00408 2/20 0.35
SIGMAR1 Q99720 1/20 0.34
GRM2 Q14416 1/20 0.34
CNR2 P34972 1/20 0.34
NOTUM Q6P988 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
MAPK14 Q16539 1/20 0.34
KDM4C Q9H3R0 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
SCHEMBL27321857 0.93 HSD11B1 (0.43) HSD11B1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL8163320 0.89 HSD11B1 (0.45) HSD11B1EGLN2PDE2ASIGMAR1GRM2
SCHEMBL16200058 0.84 HSD11B1 (0.40) HSD11B1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL8566222 0.81 MEN1 (0.38) HSD11B1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL8626557 0.78 HSD11B1 (0.38) HSD11B1MEN1KMT2ASLC34A1EGLN2
SCHEMBL8570221 0.78 MEN1 (0.37) HSD11B1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL7524976 0.78 CYP1A2 (0.39) HSD11B1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL8565103 0.78 MEN1 (0.37) HSD11B1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL7615238 0.77 MEN1 (0.36) HSD11B1MEN1CYP1A2CYP2C9CYP2C19
SCHEMBL6289041 0.77 MEN1 (0.36) HSD11B1MEN1CYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0553307-B1 HERBICIDAL SUBSTITUTED ARYL-HALOALKYLPYRAZOLES MONSANTO CO (US) 1998-12-09 EP disclosed
EP-0791571-A1 Benzoyl derivatives MONSANTO COMPANY (US) 1997-08-27 EP disclosed
US-5536700-A Herbicidal compositions comprising aryl-5-haloalkylpyrazoles and glyphosate, it's salts, diquat or paraquat MONSANTO COMPANY (US) 1996-07-16 US disclosed
US-5530126-A ALKYLATION IN INERT SOLVENT MONSANTO COMPANY (US) 1996-06-25 US disclosed
US-5496956-A BY ESTERIFICATION OF CARBOXY SUBSTITUTION WITH ALCOHOLS IN THE PRESENCE OF MINERAL ACID MONSANTO COMPANY (US) 1996-03-05 US disclosed
US-5489571-A CROP-SAFE COMPOUNDS EFFECTIVE AT LOW CONCENTRATIONS MONSANTO COMPANY (US) 1996-02-06 US disclosed
US-5281571-A Herbicidal benzoxazinone- and benzothiazinone-substituted pyrazoles MONSANTO COMPANY (US) 1994-01-25 US disclosed
EP-0553307-A1 HERBICIDAL SUBSTITUTED ARYL-HALOALKYLPYRAZOLES MONSANTO COMPANY (US) 1993-08-04 EP disclosed
WO-1992006962-A1 HERBICIDAL SUBSTITUTED ARYL-HALOALKYLPYRAZOLES MONSANTO COMPANY (US) 1992-04-30 WO disclosed