SCHEMBL10772905

SCHEMBL10772905

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

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.61
▸ MEN1 O00255 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ TTR P02766 1/20 0.61
▸ PPOX P50336 1/20 0.61
▸ LMNA P02545 5/20 0.40
▸ MAPT P10636 4/20 0.40
▸ POLB P06746 2/20 0.40
▸ CCR6 P51684 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ GPR55 Q9Y2T6 1/20 0.40
▸ FFAR1 O14842 2/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ PYGL P06737 1/20 0.38
▸ MRGPRX4 Q96LA9 1/20 0.37
▸ STK39 Q9UEW8 1/20 0.37
▸ HTR2A P28223 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36

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
SCHEMBL10773683 0.91 TDP1 (0.64) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10775166 0.89 TDP1 (0.61) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10777712 0.89 TDP1 (0.61) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10772937 0.89 TDP1 (0.61) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10775887 0.89 TDP1 (0.61) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10772092 0.89 TDP1 (0.61) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10775141 0.88 TDP1 (0.60) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10775168 0.88 TDP1 (0.64) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10777767 0.87 MEN1 (0.59) TDP1MEN1KMT2ATTRPPOX
SCHEMBL10775577 0.87 TDP1 (0.61) 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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