SCHEMBL8773215

SCHEMBL8773215

N#Cc1cc(Oc2cccc(C(F)(F)F)c2)nc(Oc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.50
CYP2C9 P11712 2/20 0.50
CYP2C19 P33261 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
POLB P06746 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
MAPT P10636 1/20 0.49
RECQL P46063 1/20 0.48
ALDH1A1 P00352 2/20 0.48
ABCG2 Q9UNQ0 1/20 0.46
P2RY1 P47900 1/20 0.46
LRRK2 Q5S007 1/20 0.45
ADORA2A P29274 1/20 0.45
LOX P28300 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 2/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CTSS P25774 1/20 0.43

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
SCHEMBL8773213 0.91 MAPT (0.48) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL8773244 0.88 GRM5 (0.47) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL8548872 0.87 POLB (0.43) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL6608734 0.85 POLB (0.42) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL6610250 0.85 POLB (0.42) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL8471818 0.84 PSD (0.41) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL8552730 0.84 POLB (0.41) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL6615326 0.84 POLB (0.42) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL8546808 0.83 POLB (0.43) CYP1A2CYP2C9CYP2C19L3MBTL1POLB
SCHEMBL7077333 0.83 POLB (0.50) CYP1A2CYP2C9CYP2C19L3MBTL1POLB

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-5691277-A REACTING A 2,6-DIHALOGENOPYRIDINE WITH A META SUBSTITUTED PHENOL KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1997-11-25 US disclosed
EP-0692474-B1 2- (unsubstituted or substituted) (benzyloxy or phenoxy)-4-substituted-6-(meta-substituted phenoxy) pyridine, process for producing the same, and herbicidal composition KUREHA CHEMICAL IND CO LTD (JP) 1997-10-29 EP disclosed
EP-0692474-A1 2- (unsubstituted or substituted) (benzyloxy or phenoxy)-4-substituted-6-(meta-substituted phenoxy) pyridine, process for producing the same, and herbicidal composition KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1996-01-17 EP disclosed