SCHEMBL9600755

SCHEMBL9600755

COC(=O)CN(O)C(=O)c1cc(Oc2ccc(Cl)c(C)c2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.51
▸ KMT2A Q03164 6/20 0.43
▸ MEN1 O00255 5/20 0.43
▸ TTR P02766 2/20 0.43
▸ PPOX P50336 1/20 0.43
▸ ALDH1A1 P00352 7/20 0.37
▸ TBXA2R P21731 2/20 0.36
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ LMNA P02545 4/20 0.35
▸ HPGD P15428 3/20 0.35
▸ MAPT P10636 3/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ RAF1 P04049 1/20 0.35
▸ GFER P55789 1/20 0.35
▸ PAX8 Q06710 1/20 0.35
▸ PKM P14618 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35

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
SCHEMBL9602400 0.83 TDP1 (0.51) TDP1KMT2AMEN1TTRPPOX
SCHEMBL9600761 0.83 TDP1 (0.51) TDP1KMT2AMEN1TTRPPOX
SCHEMBL10696879 0.83 TDP1 (0.67) TDP1KMT2AMEN1TTRPPOX
SCHEMBL9601597 0.81 KMT2A (0.62) TDP1KMT2AMEN1TTRPPOX
SCHEMBL9503150 0.80 TDP1 (0.50) TDP1KMT2AMEN1TTRPPOX
SCHEMBL9546892 0.80 TDP1 (0.55) TDP1KMT2AMEN1TTRPPOX
SCHEMBL9601648 0.80 TDP1 (0.49) TDP1KMT2AMEN1TTRPPOX
SCHEMBL10452398 0.75 LMNA (0.56) TDP1KMT2AMEN1TTRPPOX
SCHEMBL9503159 0.72 TDP1 (0.38) TDP1KMT2AMEN1ALDH1A1TBXA2R
SCHEMBL10696902 0.72 TDP1 (0.73) TDP1KMT2AMEN1TTRPPOX

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-0357807-B1 NOVEL 2-NITRO-5-(SUBSTITUTED PHENOXY) BENZOHYDROXIMIC ACID DERIVATIVES MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-01-27 — — EP disclosed
US-4931088-A HERBICIDES MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1990-06-05 — — US disclosed
EP-0357807-A1 Novel 2-nitro-5-(substituted phenoxy) benzohydroximic acid derivatives MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1990-03-14 — — EP disclosed
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