SCHEMBL9600761

SCHEMBL9600761

COC(=O)CONC(=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
▸ MEN1 O00255 5/20 0.43
▸ KMT2A Q03164 5/20 0.43
▸ TTR P02766 2/20 0.43
▸ PPOX P50336 1/20 0.43
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ ALB P02768 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ TBXA2R P21731 2/20 0.36
▸ LMNA P02545 3/20 0.36
▸ PKM P14618 2/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 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 1.00 TDP1 (0.51) TDP1MEN1KMT2ATTRPPOX
SCHEMBL9503150 0.84 TDP1 (0.50) TDP1MEN1KMT2ATTRPPOX
SCHEMBL9601648 0.83 TDP1 (0.49) TDP1MEN1KMT2ATTRPPOX
SCHEMBL9600755 0.83 TDP1 (0.51) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10696886 0.83 MEN1 (0.67) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10696882 0.81 TDP1 (0.41) TDP1MEN1KMT2ATTRPPOX
SCHEMBL9601597 0.81 KMT2A (0.62) TDP1MEN1KMT2ATTRPPOX
SCHEMBL9546892 0.80 TDP1 (0.55) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10452399 0.75 LMNA (0.56) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10696906 0.73 TDP1 (0.72) 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 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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