SCHEMBL6579274

SCHEMBL6579274

CC(C)=CCCC(C)=CCOc1c(O)c2cccc(C)c2n(Cc2ccccc2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.46
ALOX15 P16050 6/20 0.43
ATM Q13315 1/20 0.43
TRPV1 Q8NER1 1/20 0.42
MAPT P10636 3/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
BACE1 P56817 3/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2E1 P05181 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
CYP2B6 P20813 1/20 0.38
CYP3A5 P20815 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL6579268 1.00 TDP1 (0.46) TDP1ALOX15ATMTRPV1MAPT
SCHEMBL6581180 0.92 TDP1 (0.45) TDP1ALOX15TRPV1MAPTALDH1A1
SCHEMBL6581174 0.92 TDP1 (0.45) TDP1ALOX15TRPV1MAPTALDH1A1
SCHEMBL6581706 0.88 ALOX15 (0.43) TDP1ALOX15TRPV1MAPTALDH1A1
SCHEMBL6581714 0.88 ALOX15 (0.43) TDP1ALOX15TRPV1MAPTALDH1A1
SCHEMBL7974886 0.79 TDP1 (0.46) TDP1ALOX15ATMTRPV1MAPT
SCHEMBL7974889 0.79 TDP1 (0.46) TDP1ALOX15ATMTRPV1MAPT
SCHEMBL6579305 0.76 ALOX15 (0.44) TDP1ALOX15ATMMAPTALDH1A1
SCHEMBL6579311 0.76 ALOX15 (0.44) TDP1ALOX15ATMMAPTALDH1A1
SCHEMBL6581949 0.74 PPARG (0.43) TDP1ALOX15ATMTRPV1MAPT

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