SCHEMBL11272095

SCHEMBL11272095

CS(=O)(=O)NC(=O)c1cc(Oc2ccc(OC(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.55
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ TTR P02766 1/20 0.51
▸ PPOX P50336 1/20 0.51
▸ SCN9A Q15858 16/20 0.50
▸ GAA P10253 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ SCN2B O60939 1/20 0.40
▸ SCN1A P35498 1/20 0.40
▸ SCN1B Q07699 1/20 0.40
▸ SCN5A Q14524 1/20 0.40

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
SCHEMBL11367437 0.88 TDP1 (0.57) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10667783 0.88 TDP1 (0.71) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11279561 0.88 ALDH3A1 (0.43) TDP1MEN1KMT2ATTRPPOX
SCHEMBL18212630 0.87 TDP1 (0.58) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10668735 0.86 TDP1 (0.57) TDP1MEN1KMT2ATTRPPOX
Fomesafen SCHEMBL39607 0.85 TDP1 (0.71) TDP1MEN1KMT2ATTRPPOX
Fomesafen SCHEMBL30120750 0.85 TDP1 (0.71) TDP1MEN1KMT2ATTRPPOX
Fomesafen SCHEMBL29366195 0.85 TDP1 (0.71) TDP1MEN1KMT2ATTRPPOX
Fomesafen SCHEMBL16881788 0.85 TDP1 (0.71) TDP1MEN1KMT2ATTRPPOX
Fomesafen SCHEMBL8539654 0.85 TDP1 (0.71) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0063873-A1 Haloalkoxy-substituted diphenyl ethers; their use as herbicides and in herbicidal compositions and processes of making them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-11-03 — — EP disclosed
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