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Sugi Predict / Compounds / Acifluorfen

Acifluorfen

Acifluorfen

SCHEMBL9706916

CCOCN(C(=O)CCl)c1c(C)cccc1CC.CCOCN(C(=O)CCl)c1c(C)cccc1CC.Nc1c([N+](=O)[O-])ccc(Oc2ccccc2)c1Cl.Nc1c([N+](=O)[O-])ccc(Oc2ccccc2)c1Cl.O=C(O)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-].O=C(O)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 5/20 0.53
▸ MEN1 O00255 5/20 0.53
▸ KMT2A Q03164 5/20 0.53
▸ TTR P02766 2/20 0.53
▸ PPOX P50336 1/20 0.53
▸ ALDH1A1 P00352 4/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ ALB P02768 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ MRGPRX4 Q96LA9 3/20 0.38
▸ MAPT P10636 1/20 0.36
▸ LMNA P02545 4/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ POLB P06746 1/20 0.36
▸ PYGL P06737 1/20 0.34
▸ FFAR1 O14842 3/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ PPARG P37231 1/20 0.32

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
Acifluorfen SCHEMBL9539519 0.97 TDP1 (0.49) TDP1MEN1KMT2ATTRPPOX
Acifluorfen SCHEMBL9691694 0.93 TDP1 (0.61) TDP1MEN1KMT2ATTRPPOX
Acifluorfen SCHEMBL7575506 0.93 TDP1 (0.61) TDP1MEN1KMT2ATTRPPOX
Acifluorfen SCHEMBL9451020 0.90 TDP1 (0.56) TDP1MEN1KMT2ATTRPPOX
Acifluorfen SCHEMBL9675679 0.90 TDP1 (0.56) TDP1MEN1KMT2ATTRPPOX
Acetochlor SCHEMBL7582013 0.86 TDP1 (0.58) TDP1MEN1KMT2ATTRALDH1A1
Acifluorfen SCHEMBL7581416 0.85 TDP1 (0.51) TDP1MEN1KMT2ATTRPPOX
Acifluorfen SCHEMBL7578174 0.85 TDP1 (0.49) TDP1MEN1KMT2ATTRPPOX
Acifluorfen SCHEMBL7580247 0.85 TDP1 (0.51) TDP1MEN1KMT2ATTRPPOX
Oxyfluorfen SCHEMBL7582962 0.85 ALDH1A1 (0.51) TDP1MEN1KMT2ATTRPPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992013861-A1 HERBICIDAL BICYCLIC ETHERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-20 — — WO disclosed
WO-1992010501-A1 HERBICIDAL ETHERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-06-25 — — WO disclosed