SCHEMBL6911265

SCHEMBL6911265

Fc1ccc(-c2cc(C(F)(F)F)n[nH]2)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC8 Q09428 1/20 0.45
KCNJ11 Q14654 1/20 0.45
ALPL P05186 3/20 0.38
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
NPC1 O15118 3/20 0.35
ALOX15 P16050 2/20 0.35
RAB9A P51151 2/20 0.35
KIT P10721 1/20 0.35
ALDH1A1 P00352 1/20 0.35
THRB P10828 1/20 0.35
HPGD P15428 1/20 0.35
TRPA1 O75762 1/20 0.35
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
MAPT P10636 1/20 0.33
NFKB1 P19838 1/20 0.33
CASP1 P29466 1/20 0.33
CASP3 P42574 1/20 0.33
NFKB2 Q00653 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
SCHEMBL6909425 0.87 ABCC8 (0.36) ABCC8KCNJ11MEN1KMT2ANPC1
SCHEMBL19879314 0.84 ABCC8 (0.35) ABCC8KCNJ11MEN1KMT2ANPC1
SCHEMBL867635 0.83 ABCC8 (0.38) ABCC8KCNJ11ALPLMEN1KMT2A
SCHEMBL13024369 0.81 SMN1; SMN2 (0.47) MEN1KMT2ANPC1ALOX15RAB9A
SCHEMBL16405017 0.81 ABCC8 (0.37) ABCC8KCNJ11ALPLMEN1KMT2A
SCHEMBL16404995 0.81 ALPL (0.38) ABCC8KCNJ11ALPLMEN1KMT2A
SCHEMBL20414938 0.79 ABCC8 (0.38) ABCC8KCNJ11ALPLTRPA1PDE3B
SCHEMBL23412513 0.78 PDE10A (0.40) ABCC8KCNJ11ALPLMEN1KMT2A
SCHEMBL6331111 0.77 AXL (0.54) MEN1KMT2ANPC1RAB9AKIT
SCHEMBL12322371 0.77 ALPL (0.36) ABCC8KCNJ11ALPLMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0791571-B1 Benzoyl derivatives BAYER CROPSCIENCE AG (DE) 2004-06-16 EP disclosed
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
CN-1030595-C Substituted aryl-haloalkyl-pyrazoles as herbicides MONSANTO CO (US) 1996-01-03 CN 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