SCHEMBL10663135

SCHEMBL10663135

CS(=O)(=O)NC(=O)c1cc(Oc2c(F)c(F)c(C(F)(F)F)c(F)c2F)ccc1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TTR P02766 1/20 0.41
▸ PPOX P50336 1/20 0.41
▸ SCN9A Q15858 9/20 0.40
▸ FLT1 P17948 1/20 0.37
▸ FLT4 P35916 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ LMNA P02545 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ ALDH3A1 P30838 1/20 0.36
▸ MITF O75030 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ CCR6 P51684 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ FBP1 P09467 1/20 0.34

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
SCHEMBL31118331 0.92 SCN9A (0.44) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10666985 0.86 MEN1 (0.45) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10671105 0.83 TDP1 (0.54) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10658377 0.82 TDP1 (0.57) TDP1MEN1KMT2ATTRPPOX
SCHEMBL8923180 0.82 SCN9A (0.43) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10667556 0.82 TDP1 (0.51) TDP1MEN1KMT2ATTRPPOX
SCHEMBL31118268 0.81 TDP1 (0.40) TDP1MEN1KMT2ATTRPPOX
SCHEMBL31118464 0.80 ALDH3A1 (0.40) MEN1KMT2ALMNAPOLBALDH3A1
SCHEMBL10775569 0.80 KMT2A (0.40) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10673393 0.80 TDP1 (0.56) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4780128-A Herbicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-10-25 — — US disclosed
US-4738711-A POST- AND PREEMERGENCE HERBICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-04-19 — — US disclosed
US-4465508-A Diphenyl ether herbicides IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-08-14 — — US disclosed
EP-0023392-B1 DIPHENYL ETHER COMPOUNDS, AND HERBICIDAL COMPOSITIONS AND PROCESSES UTILISING THEM IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-06-06 — — EP disclosed
EP-0023392-A2 Diphenyl ether compounds, and herbicidal compositions and processes utilising them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-02-04 — — EP disclosed
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