SCHEMBL6609245

SCHEMBL6609245

COc1cc(OCCSC(F)(F)F)nc(Oc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
L3MBTL1 Q9Y468 5/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 2/20 0.42
GAA P10253 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
PPP1CA P62136 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KIF11 P52732 1/20 0.39
LTA4H P09960 1/20 0.38
P2RY1 P47900 1/20 0.38
NTRK1 P04629 1/20 0.38
LRRK2 Q5S007 1/20 0.38
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL6609777 0.94 MAPT (0.44) MAPTL3MBTL1ALDH1A1POLBMAPK1
SCHEMBL6611181 0.90 ALDH1A1 (0.45) MAPTL3MBTL1ALDH1A1POLBMAPK1
SCHEMBL6608734 0.85 POLB (0.42) MAPTL3MBTL1ALDH1A1POLBMAPK1
SCHEMBL6610274 0.84 L3MBTL1 (0.44) MAPTL3MBTL1ALDH1A1POLBMAPK1
SCHEMBL8773209 0.84 MAPT (0.58) MAPTL3MBTL1ALDH1A1POLBMAPK1
SCHEMBL6610496 0.82 L3MBTL1 (0.38) MAPTL3MBTL1ALDH1A1POLBGAA
SCHEMBL8773242 0.81 MAOB (0.48) MAPTL3MBTL1ALDH1A1POLBMAPK1
SCHEMBL6615326 0.80 POLB (0.42) MAPTL3MBTL1ALDH1A1POLBMAPK1
SCHEMBL6611301 0.78 ATP1A1 (0.33) MAPTL3MBTL1KDM4E
SCHEMBL6611694 0.77 L3MBTL1 (0.38) MAPTL3MBTL1ALDH1A1POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1228062-B1 HERBICIDAL 2-ARYLOXY-6-FLUOROALKYLTHIOALK(EN)YLOXY-PYRIDINES BASF AG (DE) 2004-04-28 EP claimed
US-6534447-B1 2,6-disubstituted pyridine derivatives in which a fluoroalkylthioalk(en)yloxy group is attached to the pyridine group in the 2-position BASF AKTIENGESELLSCHAFT (DE) 2003-03-18 US claimed
EP-1228062-A1 HERBICIDAL 2-ARYLOXY-6-FLUOROALKYLTHIOALK(EN)YLOXY-PYRIDINES BASF AKTIENGESELLSCHAFT (DE) 2002-08-07 EP claimed
WO-2001036410-A1 HERBICIDAL 2-ARYLOXY-6-FLUOROALKYLTHIOALK(EN)YLOXY-PYRIDINE BASF AKTIENGESELLSCHAFT (DE) 2001-05-25 WO claimed
EP-1228062-B1 HERBICIDAL 2-ARYLOXY-6-FLUOROALKYLTHIOALK(EN)YLOXY-PYRIDINES BASF AG (DE) 2004-04-28 EP disclosed
US-6534447-B1 2,6-disubstituted pyridine derivatives in which a fluoroalkylthioalk(en)yloxy group is attached to the pyridine group in the 2-position BASF AKTIENGESELLSCHAFT (DE) 2003-03-18 US disclosed
EP-1228062-A1 HERBICIDAL 2-ARYLOXY-6-FLUOROALKYLTHIOALK(EN)YLOXY-PYRIDINES BASF AKTIENGESELLSCHAFT (DE) 2002-08-07 EP disclosed
WO-2001036410-A1 HERBICIDAL 2-ARYLOXY-6-FLUOROALKYLTHIOALK(EN)YLOXY-PYRIDINE BASF AKTIENGESELLSCHAFT (DE) 2001-05-25 WO disclosed