SCHEMBL6576708

SCHEMBL6576708

COc1cccc2c(O)c(O)c(=O)[nH]c12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.56
NQO2 P16083 1/20 0.54
KDM4E B2RXH2 7/20 0.53
HPGD P15428 6/20 0.53
MAPT P10636 5/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
POLB P06746 2/20 0.53
MCL1 Q07820 2/20 0.53
GAA P10253 2/20 0.53
LMNA P02545 2/20 0.53
BLM P54132 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
RECQL P46063 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
GLA P06280 1/20 0.51
IDE P14735 1/20 0.47
MPI P34949 1/20 0.47

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
SCHEMBL6579896 0.87 ALDH1A1 (0.61) ALDH1A1NQO2KDM4EHPGDMAPT
SCHEMBL29957066 0.77 ALDH1A1 (0.60) ALDH1A1NQO2KDM4EHPGDMAPT
SCHEMBL3423322 0.76 NQO2 (0.57) ALDH1A1NQO2KDM4EHPGDMAPT
SCHEMBL28325027 0.76 KDM4E (0.62) ALDH1A1NQO2KDM4EHPGDMAPT
SCHEMBL9189465 0.73 ALDH1A1 (0.44) ALDH1A1NQO2KDM4EHPGDMAPT
SCHEMBL6402848 0.73 HPGD (0.57) ALDH1A1NQO2KDM4EHPGDMAPT
Edulitine SCHEMBL30631639 0.72 NQO2 (0.76) ALDH1A1NQO2KDM4EHPGDMAPT
Edulitine SCHEMBL3188973 0.72 NQO2 (0.76) ALDH1A1NQO2KDM4EHPGDMAPT
SCHEMBL5879163 0.72 KDM4E (0.55) ALDH1A1NQO2KDM4EHPGDMAPT
SCHEMBL3916662 0.72 DAO (0.53) ALDH1A1NQO2KDM4EHPGDMAPT

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 7 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-0785190-B1 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK & CHEMICALS (JP) 2000-08-16 EP disclosed
US-5942521-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-08-24 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
EP-0785190-A2 Quinolinone derivative and antiallergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-07-23 EP disclosed