SCHEMBL3457474

SCHEMBL3457474

FC(F)(F)c1cccc(Oc2cccc(Cl)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.58
NTRK1 P04629 1/20 0.52
L3MBTL1 Q9Y468 3/20 0.51
ALDH1A1 P00352 2/20 0.50
POLB P06746 1/20 0.50
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.45
LRRK2 Q5S007 1/20 0.44
TEAD1 P28347 2/20 0.44
ADORA2A P29274 1/20 0.44
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
PPARG P37231 4/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 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
SCHEMBL8508301 0.92 MAPT (0.54) MAPTNTRK1L3MBTL1ALDH1A1POLB
SCHEMBL29607042 0.89 MAPT (0.65) MAPTNTRK1L3MBTL1ALDH1A1POLB
SCHEMBL8773158 0.89 MAPT (0.65) MAPTNTRK1L3MBTL1ALDH1A1POLB
SCHEMBL8631524 0.87 MAPT (0.47) MAPTNTRK1L3MBTL1ALDH1A1POLB
SCHEMBL6941924 0.84 NTRK1 (0.71) MAPTNTRK1L3MBTL1ALDH1A1POLB
SCHEMBL9490952 0.83 L3MBTL1 (0.62) MAPTNTRK1L3MBTL1ALDH1A1CYP1A2
SCHEMBL8773192 0.83 MAPT (0.52) MAPTNTRK1L3MBTL1ALDH1A1POLB
SCHEMBL8941516 0.83 MAPT (0.59) MAPTNTRK1L3MBTL1ALDH1A1POLB
SCHEMBL8723629 0.82 MAPT (0.52) MAPTNTRK1L3MBTL1ALDH1A1POLB
SCHEMBL7783065 0.82 ALDH1A1 (0.54) MAPTNTRK1L3MBTL1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2264010-A1 Hetarylamidines Bayer CropScience AG (DE) 2010-12-22 EP disclosed
EP-0802189-B1 Process of preparation of Arylamides heteroaromatic Carboxylic acids LONZA AG (CH) 2004-03-24 EP disclosed
EP-0798296-B1 Process of preparation of Arylamides Heteroaromatic Carboxylic Acids LONZA AG (CH) 2003-12-10 EP disclosed
US-6635766-B1 By the reaction of heteroaromatic halogen compounds with carbon monoxide and aromatic amines in the presence of a catalyst and a base LONZA AG (CH) 2003-10-21 US disclosed
US-6271372-B1 REACTING HETEROAROMATIC HALOGEN COMPOUNDS WITH CARBON MONOXIDE AND AROMATIC AMINES IN THE PRESENCE OF A COMPLEX OF PALLADIUM WITH A TRIPHENYLPHOSPHINE AND A BASE OTHER THAN AN AMINE. LONZA AG (CH) 2001-08-07 US disclosed
US-6175011-B1 PREPARING ARYLOXY ARYLAMIDES OF PYRIDINE-, PYRIMIDINE-, PYRAZINE- AND 1,3,5-TRIAZINE-CARBOXYLIC ACIDS BY REACTING THE HETEROAROMATIC DIHALIDE WITH AN AROMATIC HYDROXY THEN WITH CARBON MONOXIDE AND AN ARYLAMINE USING DIPHOSPHINE CATALYST LONZA AG (CH) 2001-01-16 US disclosed
EP-0806415-B1 Process for the preparation of arylamides of heteroaromatic carboxylic acids LONZA AG (CH) 2000-02-16 EP disclosed
US-5922870-A Process for the preparation of arylamides of heteroaromatic carboxylic acids LONZA AG (CH) 1999-07-13 US disclosed
US-5900484-A FROM HETEROAROMATIC HALOGEN COMPOUNDS AND AROMATIC AMINES AND CARBON MONOXIDE WITH PALLADIUM PHOSPHINE COMPLEX LONZA AG (CH) 1999-05-04 US disclosed
EP-0572093-B1 Herbicidal 2,6-substituted pyridines SHELL INT RESEARCH (NL) 1999-04-14 EP disclosed
US-5892032-A Process for the preparation of arylamides of heteroaromatic carboxylic acids LONZA AG (CH) 1999-04-06 US disclosed
EP-0806415-A1 Process for the preparation of arylamides of heteroaromatic carboxylic acids LONZA AG (CH) 1997-11-12 EP disclosed
EP-0802189-A2 Process of preparation of Arylamides heteroarmatic Carboxylic acids Lonza AG (CH) 1997-10-22 EP disclosed
EP-0798296-A2 Process of preparation of Arylamides Heteroaromatic Carboxylic Acids LONZA AG (CH) 1997-10-01 EP disclosed
US-5374604-A 2,6-diphenoxypyridine as pre-emergence herbicides AMERICAN CYANAMID COMPANY (US) 1994-12-20 US disclosed
EP-0572093-A1 Herbicidal 2,6-substituted pyridines SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1993-12-01 EP disclosed