Aclonifen

Aclonifen

SCHEMBL9711313

C=CC=O.C=CC=O.Nc1c([N+](=O)[O-])ccc(Oc2ccccc2)c1Cl.Nc1c([N+](=O)[O-])ccc(Oc2ccccc2)c1Cl

nearest known ligand 0.85

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.85
KMT2A Q03164 4/20 0.85
TTR P02766 1/20 0.85
ALB P02768 1/20 0.85
THRB P10828 1/20 0.85
TDP1 Q9NUW8 1/20 0.85
PDE7A Q13946 2/20 0.44
PIN1 Q13526 3/20 0.40
HPSE Q9Y251 1/20 0.39
MAPT P10636 4/20 0.39
ALDH1A1 P00352 3/20 0.39
HTR6 P50406 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
LMNA P02545 3/20 0.38
TLR4 O00206 1/20 0.38
TLR2 O60603 1/20 0.38

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
Aclonifen SCHEMBL29470834 0.92 MEN1 (1.00) MEN1KMT2ATTRALBTHRB
Aclonifen SCHEMBL4894870 0.92 MEN1 (1.00) MEN1KMT2ATTRALBTHRB
Aclonifen SCHEMBL55487 0.92 MEN1 (1.00) MEN1KMT2ATTRALBTHRB
Aclonifen SCHEMBL2297957 0.85 MEN1 (0.81) MEN1KMT2ATTRALBTHRB
Acifluorfen SCHEMBL9715148 0.79 TDP1 (0.71) MEN1KMT2ATTRALBTHRB
SCHEMBL11064915 0.79 MEN1 (0.75) MEN1KMT2ATTRALBTHRB
SCHEMBL21681375 0.79 MEN1 (0.75) MEN1KMT2ATTRALBTHRB
SCHEMBL30623820 0.79 MEN1 (0.75) MEN1KMT2ATTRALBTHRB
Aclonifen SCHEMBL7589599 0.77 TDP1 (0.70) MEN1KMT2ATTRALBTHRB
SCHEMBL10883530 0.76 TDP1 (0.71) MEN1KMT2ATTRALBTHRB

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 1 patent. 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