SCHEMBL8764277

SCHEMBL8764277

O=C(O)c1cc(Oc2ccc(C(Cl)(Cl)Cl)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.81
KMT2A Q03164 4/20 0.81
TDP1 Q9NUW8 3/20 0.81
TTR P02766 2/20 0.81
PPOX P50336 1/20 0.81
DTYMK P23919 1/20 0.42
HPSE Q9Y251 1/20 0.41
FFAR1 O14842 2/20 0.41
PDE7A Q13946 1/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
ALDH1A1 P00352 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
PYGL P06737 1/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CCR6 P51684 1/20 0.39
GPR55 Q9Y2T6 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
SCHEMBL10685102 0.90 TDP1 (0.84) MEN1KMT2ATDP1TTRPPOX
Acifluorfen SCHEMBL3228873 0.90 TDP1 (1.00) MEN1KMT2ATDP1TTRPPOX
Acifluorfen SCHEMBL38929 0.90 TDP1 (1.00) MEN1KMT2ATDP1TTRPPOX
Acifluorfen SCHEMBL29448829 0.90 TDP1 (1.00) MEN1KMT2ATDP1TTRPPOX
Acifluorfen SCHEMBL29445767 0.90 TDP1 (1.00) MEN1KMT2ATDP1TTRPPOX
Acifluorfen SCHEMBL8028079 0.90 TDP1 (1.00) MEN1KMT2ATDP1TTRPPOX
Acifluorfen SCHEMBL1830812 0.89 TDP1 (0.98) MEN1KMT2ATDP1TTRPPOX
Acifluorfen SCHEMBL10556004 0.89 TDP1 (0.98) MEN1KMT2ATDP1TTRPPOX
Acifluorfen SCHEMBL3690938 0.89 TDP1 (0.98) MEN1KMT2ATDP1TTRPPOX
SCHEMBL10685130 0.88 MEN1 (0.84) MEN1KMT2ATDP1TTRPPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0238240-B2 Dry reactive processing UNIROYAL CHEM CO INC (US) 1997-06-18 EP disclosed
US-5070197-A WATER-SOLUBLE PESTICIDES; ONE STEP; CONTINUOUS PROCESSING UNIROYAL CHEMICAL COMPANY, INC. (US) 1991-12-03 US disclosed
EP-0238240-A2 Dry reactive processing UNIROYAL CHEMICAL COMPANY, Inc. (US) 1987-09-23 EP disclosed