SCHEMBL10775588

SCHEMBL10775588

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

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.71
▸ MEN1 O00255 3/20 0.71
▸ KMT2A Q03164 3/20 0.71
▸ TTR P02766 1/20 0.71
▸ PPOX P50336 1/20 0.71
▸ MAPT P10636 5/20 0.43
▸ LMNA P02545 4/20 0.43
▸ FFAR1 O14842 4/20 0.43
▸ POLB P06746 2/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.43
▸ CCR6 P51684 1/20 0.43
▸ GPR55 Q9Y2T6 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ PYGL P06737 1/20 0.40
▸ HTR2A P28223 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39

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
SCHEMBL10775502 0.89 TDP1 (0.67) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10778152 0.89 TDP1 (0.67) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10779086 0.89 TDP1 (0.67) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10775985 0.89 MEN1 (0.66) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10775196 0.88 TDP1 (0.74) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10772924 0.88 TDP1 (0.65) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10777624 0.88 TDP1 (0.65) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10772108 0.88 TDP1 (0.65) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10777745 0.87 TDP1 (0.72) TDP1MEN1KMT2ATTRPPOX
Acifluorfen-Methyl SCHEMBL39092 0.87 MEN1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4690708-A Herbicides derived from aryloxybenzenecarboxylic acid imides RHONE-POULENC AGROCHIMIE (FR) 1987-09-01 — — US disclosed
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