SCHEMBL10775218

SCHEMBL10775218

NC(=O)c1cc(Oc2ncc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.58
▸ KMT2A Q03164 3/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ TDP1 Q9NUW8 2/20 0.56
▸ TTR P02766 1/20 0.56
▸ PPOX P50336 1/20 0.56
▸ RAB9A P51151 1/20 0.52
▸ LMNA P02545 5/20 0.51
▸ FAAH O00519 1/20 0.50
▸ ATM Q13315 1/20 0.48
▸ LIPE Q05469 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ MAPT P10636 3/20 0.47
▸ XBP1 P17861 2/20 0.47
▸ HTT P42858 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ FFAR1 O14842 1/20 0.46
▸ POLB P06746 1/20 0.46

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
SCHEMBL10452504 0.91 KMT2A (0.69) SMN1; SMN2KMT2AMEN1TDP1TTR
Potassium Ion SCHEMBL11458215 0.90 KMT2A (0.56) SMN1; SMN2KMT2AMEN1TDP1TTR
SCHEMBL11455998 0.90 KMT2A (0.56) SMN1; SMN2KMT2AMEN1TDP1TTR
SCHEMBL11455024 0.88 KMT2A (0.61) SMN1; SMN2KMT2AMEN1TDP1TTR
SCHEMBL10772903 0.86 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AMEN1TDP1TTR
SCHEMBL10848703 0.86 RAB9A (0.56) SMN1; SMN2KMT2AMEN1TDP1TTR
SCHEMBL10772766 0.85 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AMEN1TDP1TTR
SCHEMBL11153730 0.85 RAB9A (0.62) SMN1; SMN2KMT2AMEN1TDP1TTR
SCHEMBL11016710 0.85 CYP1A2 (0.54) SMN1; SMN2KMT2AMEN1TDP1TTR
SCHEMBL11005246 0.84 SMN1; SMN2 (0.51) SMN1; SMN2KMT2AMEN1TDP1TTR

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
Send feedback