SCHEMBL8000647

SCHEMBL8000647

COc1c(OC)c2ccc(N(C)C)cc2n(C)c1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
KDM4E B2RXH2 6/20 0.61
HSD17B10 Q99714 4/20 0.61
HPGD P15428 3/20 0.61
GAA P10253 3/20 0.61
GLA P06280 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MAPT P10636 2/20 0.52
THRB P10828 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
USP2 O75604 1/20 0.40
PKM P14618 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
APP P05067 1/20 0.38
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
CYP19A1 P11511 1/20 0.36

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
SCHEMBL8000536 0.92 ALDH1A1 (0.53) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL8000809 0.88 KDM4E (0.52) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL7988598 0.86 ALDH1A1 (0.50) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL7998821 0.79 ALDH1A1 (0.53) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL7997999 0.78 BRPF1 (0.44) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL7997475 0.76 KDM4E (0.53) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL8004883 0.75 KDM4E (0.42) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL6579613 0.74 ALDH1A1 (0.51) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL6578988 0.74 ALDH1A1 (0.57) ALDH1A1KDM4EHSD17B10HPGDGAA
SCHEMBL7989425 0.74 ALDH1A1 (0.42) ALDH1A1KDM4EHSD17B10HPGDGAA

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