SCHEMBL7848338

SCHEMBL7848338

Cc1nn(-c2ccc([N+](=O)[O-])cc2F)c(=O)n1C(F)F

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
MAPT P10636 2/20 0.44
THRB P10828 1/20 0.44
PPOX P50336 1/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 2/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL9428190 0.90 PPOX (0.43) ALDH1A1PPOX
SCHEMBL8817179 0.84 KMT2A (0.43) ALDH1A1KMT2AMAPTTHRBLMNA
SCHEMBL9427513 0.84 PPOX (0.56) ALDH1A1KMT2APPOXMEN1HTT
SCHEMBL30537047 0.82 PPOX (0.43) PPOX
SCHEMBL9631118 0.82 PPOX (0.43) PPOX
SCHEMBL6658377 0.81 PPOX (0.51) PPOX
SCHEMBL7844419 0.81 PPOX (0.48) PPOX
SCHEMBL7844919 0.81 PPOX (0.46) PPOX
SCHEMBL7835753 0.81 PPOX (0.46) PPOX
SCHEMBL29576004 0.81 PPOX (0.51) PPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0656892-B1 HERBICIDAL 2- (4-HETEROCYCLIC-PHENOXYMETHYL)PHENOXY]-ALKANOATES FMC CORP (US) 2001-06-13 EP disclosed
US-5798316-A GRASS OR BROADLEAF CONTROLLING AGENTS FMC CORPORATION 1998-08-25 US disclosed
US-5674810-A MIXTURE OF TWO HERBICIDES WITH DIFFERENT STRUCTURES, CARRIER FMC CORPORATION (US) 1997-10-07 US disclosed
WO-1997008953-A1 HERBICIDAL 2-[(4-HETEROCYCLIC-PHENOXYMETHYL)PHENOXY]-ALKANOATES FMC CORPORATION (US) 1997-03-13 WO disclosed
EP-0656892-A1 HERBICIDAL 2- (4-HETEROCYCLIC-PHENOXYMETHYL)PHENOXY]-ALKANOATES FMC CORPORATION (US) 1995-06-14 EP disclosed
US-5344812-A 1-methyl-6 -trifluoromethyl-2,4-pyrimidinedione-3-yl derivative as plant growth regulators FMC CORPORATION (US) 1994-09-06 US disclosed
US-5294595-A 2-(2-Halo-5-sulfoamido-phenyl),5-oxo-1,2,4-triazoles and an additional herbicide with a carrier FMC CORPORATION (US) 1994-03-15 US disclosed
WO-1994004514-A1 HERBICIDAL 2-[(4-HETEROCYCLIC-PHENOXYMETHYL)PHENOXY]-ALKANOATES FMC CORPORATION (US) 1994-03-03 WO disclosed
US-5262390-A PLANT GROWTH REGULATORS FMC CORPORATION (US) 1993-11-16 US disclosed
EP-0294375-B1 HERBICIDAL ARYL TRIAZOLINONES FMC Corporation (US) 1993-08-18 EP disclosed
US-5214154-A Herbicidal aryl triazolinones FMC CORPORATION (US) 1993-05-25 US disclosed
US-5174809-A Herbicidal aryl triazolinones FMC CORPORATION (US) 1992-12-29 US disclosed
US-5041155-A Preemergence herbicide mixture for controlling grass; for use with soybeans, corn or sugar cane FMC CORPORATION (US) 1991-08-20 US disclosed
US-4894084-A 1,2,4-TRIAZOLONE(3-)SUBSTITUENTS PLANT GROWTH REGULATORS FMC CORPORATION (US) 1990-01-16 US disclosed
US-4818275-A PREEMERGENCE FMC CORPORATION (US) 1989-04-04 US disclosed
EP-0294375-A1 HERBICIDAL ARYL TRIAZOLINONES. FMC CORP (US) 1988-12-14 EP disclosed
EP-0294375-A4 HERBICIDAL ARYL TRIAZOLINONES. FMC CORP (US) 1988-10-20 EP disclosed
WO-1987003782-A1 HERBICIDAL ARYL TRIAZOLINONES FMC CORPORATION (US) 1987-07-02 WO disclosed