SCHEMBL7054903

SCHEMBL7054903

CN(Cc1ccccc1)c1cc(Oc2cccc(C(F)(F)F)c2)nc(C(=O)Nc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.51
GAA P10253 2/20 0.48
MAPT P10636 3/20 0.48
LOX P28300 2/20 0.47
LOXL2 Q9Y4K0 2/20 0.47
MAP2K7 O14733 1/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
FAAH O00519 1/20 0.45
RAB9A P51151 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
P2RY1 P47900 1/20 0.44
NTRK1 P04629 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 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
SCHEMBL7051675 0.89 MAPT (0.48) GAAMAPTKDM4EALDH1A1
SCHEMBL7052911 0.89 MAPT (0.51) GAAMAPTLOXL2KDM4EALDH1A1
SCHEMBL7051149 0.89 MAPT (0.53) GAAMAPTLOXLOXL2KDM4E
SCHEMBL7690178 0.82 MAPT (0.56) GAAMAPTLOXLOXL2KDM4E
SCHEMBL7052802 0.81 MAPT (0.58) GAAMAPTLOXLOXL2KDM4E
SCHEMBL20894934 0.81 GAA (0.57) GAAMAPTLOXLOXL2KDM4E
SCHEMBL7110634 0.80 ALDH1A1 (0.45) MAPTLOXLOXL2KDM4EALDH1A1
SCHEMBL7612444 0.80 MAPT (0.67) GAAMAPTLOXLOXL2KDM4E
SCHEMBL7054659 0.79 MAPT (0.53) GAAMAPTLOXLOXL2KDM4E
SCHEMBL8072760 0.78 MAPT (0.56) GAAMAPTLOXLOXL2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882715-B1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA CHEMICAL IND CO LTD (JP) 2003-04-23 EP disclosed
US-6339045-B1 CAN BE USED IN A SMALL AMOUNT, SHOWING A GOOD SELECTIVITY BETWEEN CROP AND WEED, AND CAUSING NO PHYTOTOXICITY KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 2002-01-15 US disclosed
US-6005112-A REACTING SUBSTITUTED OR UNSUBSTITUTED PYRIDINE METAL COMPOUND WITH SUBSTITUTED ISOCYANATE OR ISOTHIOCYANATE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1999-12-21 US disclosed
EP-0882715-A1 NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-12-09 EP disclosed
EP-0881217-A1 PROCESS FOR PRODUCING PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-12-02 EP disclosed