SCHEMBL7998568

SCHEMBL7998568

CCCCOc1c(OC(C)C)c(=O)n(CC)c2cc(N)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
MAPT P10636 5/20 0.39
KDM4E B2RXH2 5/20 0.39
GAA P10253 1/20 0.39
GFER P55789 1/20 0.39
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
USP2 O75604 2/20 0.34
POLB P06746 2/20 0.34
RGS12 O14924 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
BLM P54132 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PSEN1 P49768 6/20 0.33
PSEN2 P49810 6/20 0.33

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
SCHEMBL8000682 0.96 ALDH1A1 (0.38) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL7997220 0.92 MEN1 (0.40) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7997665 0.91 ALDH1A1 (0.44) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL7997102 0.90 PSEN1 (0.42) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7998014 0.90 PSEN1 (0.42) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL7997266 0.88 MEN1 (0.41) ALDH1A1MAPTKDM4EGAAMEN1
SCHEMBL8004254 0.88 MEN1 (0.41) ALDH1A1MAPTKDM4EGAAMEN1
SCHEMBL8004676 0.88 MEN1 (0.39) ALDH1A1MAPTKDM4EGAAMEN1
SCHEMBL8001776 0.87 TTR (0.39) ALDH1A1MAPTKDM4EGAAGFER
SCHEMBL8004073 0.87 ALDH1A1 (0.42) 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