SCHEMBL7997665

SCHEMBL7997665

CCCCOc1c(OCCCC)c2ccc(N)cc2n(CC)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
GAA P10253 1/20 0.44
GFER P55789 1/20 0.44
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HTT P42858 2/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
HBB P68871 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
USP2 O75604 2/20 0.37
POLB P06746 2/20 0.37
RGS12 O14924 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
BLM P54132 1/20 0.37
CACNA1B Q00975 1/20 0.37

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
SCHEMBL7989324 0.96 ALDH1A1 (0.42) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL7998315 0.96 ALDH1A1 (0.42) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL8004073 0.96 ALDH1A1 (0.42) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL8000570 0.95 ALDH1A1 (0.43) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL7989312 0.95 ALDH1A1 (0.43) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL7988492 0.94 ALDH1A1 (0.42) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL7988526 0.94 ALDH1A1 (0.42) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL8002162 0.91 MEN1 (0.44) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL8001664 0.91 KDM4E (0.41) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL7988368 0.91 ALDH1A1 (0.39) ALDH1A1MAPTKDM4EGAAGFER

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