SCHEMBL6576971

SCHEMBL6576971

CCOC(=O)c1ccc([N+](=O)[O-])cc1NC(=O)COC

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.74
KMT2A Q03164 7/20 0.65
MEN1 O00255 3/20 0.65
KDM4E B2RXH2 1/20 0.62
HSD17B10 Q99714 1/20 0.62
ALDH1A1 P00352 7/20 0.60
MAPT P10636 4/20 0.58
TP53 P04637 1/20 0.58
HPGD P15428 1/20 0.58
POLB P06746 1/20 0.54
PKM P14618 1/20 0.52
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL7997377 0.85 SMN1; SMN2 (1.00) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL6578917 0.85 KMT2A (0.70) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL6578987 0.84 SMN1; SMN2 (0.64) SMN1; SMN2KMT2AMEN1KDM4EHSD17B10
SCHEMBL6581064 0.84 SMN1; SMN2 (0.64) SMN1; SMN2KMT2AMEN1KDM4EHSD17B10
SCHEMBL6581538 0.82 SMN1; SMN2 (0.76) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL7305473 0.81 SMN1; SMN2 (0.71) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL9495805 0.81 KMT2A (0.72) SMN1; SMN2KMT2AKDM4EHSD17B10ALDH1A1
SCHEMBL38661106 0.80 KMT2A (0.74) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1
SCHEMBL6169051 0.79 SMN1; SMN2 (0.86) SMN1; SMN2KMT2AMEN1ALDH1A1MAPT
SCHEMBL6790086 0.79 KMT2A (0.72) SMN1; SMN2KMT2AMEN1KDM4EALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed