Nitrofluorfen

Nitrofluorfen

SCHEMBL9674232

O=[N+]([O-])c1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1.O=[N+]([O-])c1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1.O=[N+]([O-])c1ccc(Oc2ccc(Cl)cc2Cl)cc1.O=[N+]([O-])c1ccc(Oc2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
TTR P02766 1/20 0.58
PPOX P50336 1/20 0.58
PDE7A Q13946 2/20 0.55
FFAR1 O14842 4/20 0.51
GAA P10253 1/20 0.48
PKM P14618 1/20 0.48
HSPB1 P04792 2/20 0.48
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALDH1A1 P00352 2/20 0.46
RAB9A P51151 1/20 0.46
KDM4E B2RXH2 1/20 0.45

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
Nitrofluorfen SCHEMBL29370618 0.95 MEN1 (0.63) MEN1KMT2ATDP1TTRPPOX
Nitrofluorfen SCHEMBL39312 0.95 MEN1 (0.63) MEN1KMT2ATDP1TTRPPOX
Nitrofluorfen SCHEMBL8537296 0.95 MEN1 (0.63) MEN1KMT2ATDP1TTRPPOX
Nitrofluorfen SCHEMBL11297383 0.94 MEN1 (0.62) MEN1KMT2ATDP1TTRPPOX
Nitrofluorfen SCHEMBL11297390 0.94 MEN1 (0.62) MEN1KMT2ATDP1TTRPPOX
Nitrofen SCHEMBL29364713 0.88 PDE7A (0.68) MEN1KMT2ATDP1PDE7AFFAR1
Nitrofen SCHEMBL38981 0.88 PDE7A (0.68) MEN1KMT2ATDP1PDE7AFFAR1
Nitrofen SCHEMBL1702412 0.88 PDE7A (0.68) MEN1KMT2ATDP1PDE7AFFAR1
Nitrofluorfen SCHEMBL10963788 0.88 MEN1 (0.56) MEN1KMT2ATDP1TTRPPOX
Nitrofen SCHEMBL28057303 0.87 PDE7A (0.67) MEN1KMT2ATDP1PDE7AFFAR1

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
WO-1992020684-A1 HERBICIDAL OXATRICYCLIC ETHERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-11-26 WO disclosed
EP-0463054-A1 SELECTIVE OXABICYCLOALKANES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-01-02 EP disclosed
WO-1991015478-A1 CROP-SELECTIVE HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-10-17 WO disclosed
WO-1991003464-A1 HERBICIDAL OXABICYCLO ETHERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-03-21 WO disclosed
WO-1990010634-A1 SELECTIVE OXABICYCLOALKANES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-09-20 WO disclosed