SCHEMBL10696906

SCHEMBL10696906

O=C(O)CONC(=O)c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.72
▸ MEN1 O00255 2/20 0.72
▸ KMT2A Q03164 2/20 0.72
▸ TTR P02766 1/20 0.72
▸ PPOX P50336 1/20 0.72
▸ FFAR1 O14842 3/20 0.49
▸ LMNA P02545 5/20 0.44
▸ MAPT P10636 5/20 0.44
▸ POLB P06746 2/20 0.44
▸ CCR6 P51684 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ GPR55 Q9Y2T6 1/20 0.44
▸ PYGL P06737 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ FLT1 P17948 1/20 0.41
▸ FLT4 P35916 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ AKR1B1 P15121 1/20 0.40
▸ AKR1C4 P17516 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
SCHEMBL10696886 0.91 MEN1 (0.67) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10700375 0.90 TDP1 (0.66) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10991967 0.88 TDP1 (0.77) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10993354 0.87 MEN1 (0.74) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10698027 0.86 TDP1 (0.61) TDP1MEN1KMT2ATTRPPOX
SCHEMBL9190395 0.86 TDP1 (0.76) TDP1MEN1KMT2ATTRPPOX
SCHEMBL2262565 0.86 TDP1 (0.76) TDP1MEN1KMT2ATTRPPOX
SCHEMBL11298723 0.85 TDP1 (0.79) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10441016 0.85 TDP1 (0.78) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10441014 0.85 TDP1 (0.78) 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-0273432-A2 2-Nitro-5-(substituted phenoxy) benzohydroximate derivatives and their use as herbicide MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1988-07-06 — — EP disclosed
US-4517010-A 2-Nitro-5(substituted-phenoxy) benzoyl derivatives as herbicides RHONE-POULENC INC. (US) 1985-05-14 — — US disclosed
EP-0034883-A1 2-Nitro-5-(substituted-phenoxy) benzoyl derivatives as herbicides RHONE-POULENC INC. (US) 1981-09-02 — — EP disclosed
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