SCHEMBL6209005

SCHEMBL6209005

Cc1nc(C(F)(F)F)c(OC(=O)Cl)s1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
ALDH1A1 P00352 1/20 0.43
POLB P06746 1/20 0.41
HSD11B1 P28845 1/20 0.36
GAA P10253 1/20 0.36
COMT P21964 1/20 0.36
KDM4E B2RXH2 2/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CHRM1 P11229 1/20 0.31
ATF1 P18846 1/20 0.31
NFKB1 P19838 1/20 0.31

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
SCHEMBL2428792 0.86 MAPT (0.47) MAPTALDH1A1POLBHSD11B1GAA
SCHEMBL7552055 0.81 MEN1 (0.37) MAPTALDH1A1
SCHEMBL27267502 0.81 MAPT (0.40) MAPTALDH1A1POLBHSD11B1GAA
SCHEMBL12647580 0.80 MAPT (0.39) MAPTALDH1A1POLBHSD11B1GAA
SCHEMBL6605939 0.77 CNR1 (0.34) MAPTALDH1A1POLBHSD11B1KDM4E
SCHEMBL28830044 0.74 COMT (0.41) MAPTALDH1A1POLBHSD11B1GAA
SCHEMBL2199155 0.74 MAPT (0.56) MAPTALDH1A1POLBHSD11B1GAA
SCHEMBL9676927 0.71 MEN1 (0.37) MAPTALDH1A1POLBATF1NFKB1
SCHEMBL27397703 0.70 MEN1 (0.36) MAPTALDH1A1POLBATF1NFKB1
SCHEMBL31567863 0.70 MAPT (0.34) MAPTALDH1A1POLBGAAKDM4E

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
CN-116063285-A Substituted pyrimidine (thio) ester compound and application thereof 沈阳中化农药化工研发有限公司 2023-05-05 CN disclosed
EP-1305292-B1 BIPHENYL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2012-06-20 EP disclosed
EP-1501786-A1 BIPHENYL CARBOXAMIDES Bayer CropScience AG (DE) 2005-02-02 EP disclosed
WO-2003093223-A1 BIPHENYL CARBOXAMIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-11-13 WO disclosed
EP-1305292-A1 BIPHENYL CARBOXAMIDES Bayer CropScience AG (DE) 2003-05-02 EP disclosed
WO-2002008197-A1 BIPHENYL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2002-01-31 WO disclosed
EP-0545099-B1 Anilide derivatives and their use to combat Botrytis BASF AG (DE) 1997-03-05 EP disclosed
EP-0589313-A1 Cyclohex(en)ylcarboxamides, process for their preparation and anti-fungal agents containing them BASF Aktiengesellschaft (DE) 1994-03-30 EP disclosed
EP-0545099-A2 Anilide derivatives and their use to combat Botrytis BASF Aktiengesellschaft (DE) 1993-06-09 EP disclosed