SCHEMBL8773244

SCHEMBL8773244

N#Cc1cc(OCc2ccccc2)nc(Oc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.47
MRGPRX4 Q96LA9 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
NR4A2 P43354 2/20 0.45
POLB P06746 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LOX P28300 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAOB P27338 5/20 0.44
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
KDM4E B2RXH2 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL8773215 0.88 CYP1A2 (0.50) L3MBTL1POLBALDH1A1LOXLOXL2
SCHEMBL8545122 0.87 POLB (0.43) GRM5MRGPRX4L3MBTL1NR4A2POLB
SCHEMBL8508415 0.84 MAPT (0.52) MRGPRX4L3MBTL1NR4A2POLBALDH1A1
SCHEMBL8773242 0.84 MAOB (0.48) MRGPRX4L3MBTL1NR4A2POLBALDH1A1
SCHEMBL18049897 0.82 LOXL2 (0.55) GRM5MRGPRX4LOXLOXL2MAOB
SCHEMBL6610250 0.81 POLB (0.42) L3MBTL1POLBALDH1A1LOXLOXL2
SCHEMBL6608734 0.81 POLB (0.42) L3MBTL1POLBALDH1A1LOXLOXL2
SCHEMBL6615326 0.81 POLB (0.42) L3MBTL1POLBALDH1A1LOXLOXL2
SCHEMBL8773213 0.80 MAPT (0.48) L3MBTL1POLBALDH1A1LOXLOXL2
SCHEMBL8126321 0.80 GRM5 (0.43) GRM5MRGPRX4ALDH1A1LOXLOXL2

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