SCHEMBL8000672

SCHEMBL8000672

CCCCCCOc1c(O)c2ccc(NC(=O)/C=C/c3cc(OC)c(OC(C)=O)c(OC)c3)cc2n(C)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 3/20 0.42
HTR1A P08908 2/20 0.42
HTR2C P28335 2/20 0.42
MEN1 O00255 2/20 0.42
GAA P10253 2/20 0.42
KMT2A Q03164 2/20 0.42
CA12 O43570 2/20 0.42
CA9 Q16790 2/20 0.42
HTR2A P28223 1/20 0.42
SLC6A4 P31645 1/20 0.42
HTR7 P34969 1/20 0.42
HTR6 P50406 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
POLB P06746 1/20 0.42
TP53 P04637 1/20 0.41
BCHE P06276 8/20 0.40
ACHE P22303 7/20 0.40

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
SCHEMBL8000971 1.00 HTT (0.44) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL8000967 1.00 HTT (0.44) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL8000674 1.00 HTT (0.44) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL6579165 0.94 HTT (0.51) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL6579161 0.94 HTT (0.51) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL1710165 0.93 HTT (0.45) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL7997918 0.93 HTT (0.45) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL1710168 0.93 HTT (0.45) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL7997920 0.93 HTT (0.45) HTTSMN1; SMN2MAPTHTR1AHTR2C
SCHEMBL7989264 0.92 BCHE (0.46) BCHEACHE

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
US-6114352-A Quinolinone derivative and anti-allergic agent with said quinolinone derivative as the active ingredient DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-09-05 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-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