SCHEMBL7009339

SCHEMBL7009339

FC(F)(F)c1cccc(-c2cccc(Oc3ccnc(Cl)c3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.47
CTSS P25774 1/20 0.45
KDM1A O60341 2/20 0.42
MAPT P10636 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PDE4B Q07343 1/20 0.40
GPR52 Q9Y2T5 1/20 0.39
NTRK1 P04629 1/20 0.39
TGFBR1 P36897 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
POLB P06746 1/20 0.39
IDO1 P14902 1/20 0.39
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CDK5 Q00535 1/20 0.38
DYRK1A Q13627 1/20 0.38
CDK5R1 Q15078 1/20 0.38
DYRK2 Q92630 1/20 0.38

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
SCHEMBL7008000 0.89 TRPV1 (0.49) TRPV1
SCHEMBL8549067 0.84 CTSS (0.45) KMOCTSSKDM4EL3MBTL1CCNA2
SCHEMBL8629313 0.78 MAPT (0.45) MAPTALDH1A1NTRK1L3MBTL1POLB
SCHEMBL8627523 0.78 MAPT (0.45) MAPTALDH1A1NTRK1L3MBTL1POLB
SCHEMBL8721109 0.77 F2 (0.44) KMOL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL23943338 0.76 HSD17B14 (0.60) KMOCTSSKDM1AMAPTALDH1A1
SCHEMBL30510791 0.76 HSD17B14 (0.60) KMOCTSSKDM1AMAPTALDH1A1
SCHEMBL4718821 0.74 S1PR1 (0.50) KMOALDH1A1KDM4ETGFBR1IDO1
SCHEMBL3999574 0.74 CTSS (0.60) KMOCTSSKDM1AALDH1A1KDM4E
SCHEMBL6730811 0.74 F10 (0.49) KMOMAPTALDH1A1KDM4EPDE4B

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-0723960-B1 Herbicidal 2,6-disubstituted pyridines and 2,4-disubstituted pyrimidines BASF AG (DE) 2003-04-02 EP claimed
US-6066597-A Herbicidal 2-(hetero)aryloxy-6-arylpyridines and 2-aryl-4-(hetero)aryloxy-6-arylpyridines and 2-aryl-4-(hetero)aryloxypyrimidines AMERICAN CYANAMID COMPANY (US) 2000-05-23 US claimed
EP-0723960-A1 Herbicidal 2,6-disubstituted pyridines and 2,4-disubstituted pyrimidines American Cyanamid Company (US) 1996-07-31 EP claimed
EP-0723960-B1 Herbicidal 2,6-disubstituted pyridines and 2,4-disubstituted pyrimidines BASF AG (DE) 2003-04-02 EP disclosed
US-6066597-A Herbicidal 2-(hetero)aryloxy-6-arylpyridines and 2-aryl-4-(hetero)aryloxy-6-arylpyridines and 2-aryl-4-(hetero)aryloxypyrimidines AMERICAN CYANAMID COMPANY (US) 2000-05-23 US disclosed
US-6008161-A Herbicidal 2-(hetero)aryloxy-6-arylpyridines and 2-aryl-4-(hetero) aryloxypyrimidines AMERICAN CYANAMID COMPANY (US) 1999-12-28 US disclosed
US-5849758-A Herbicidal 2, 6-disubstituted pyridines and 2, 4-disubstituted pyrimidines AMERICAN CYANAMID COMPANY (US) 1998-12-15 US disclosed
US-5824624-A HERBICIDES WITH CARRIERS OR SURFACTANTS AMERICAN CYANAMID COMPANY (US) 1998-10-20 US disclosed
EP-0723960-A1 Herbicidal 2,6-disubstituted pyridines and 2,4-disubstituted pyrimidines American Cyanamid Company (US) 1996-07-31 EP disclosed