SCHEMBL8000879

SCHEMBL8000879

CCCCCCOc1c(OC)c2ccc(NCC)cc2[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.43
GPR17 Q13304 1/20 0.39
UNG P13051 3/20 0.38
SERPINE1 P05121 2/20 0.38
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
GHSR Q92847 1/20 0.37
DRD3 P35462 1/20 0.36
CNR2 P34972 4/20 0.35
CNR1 P21554 2/20 0.35
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL7998822 1.00 AR (0.43) ARGPR17UNGSERPINE1PSEN1
SCHEMBL8001562 0.94 AR (0.45) ARGPR17UNGSERPINE1ALDH1A1
SCHEMBL7997203 0.94 AR (0.45) ARGPR17UNGSERPINE1ALDH1A1
SCHEMBL8001153 0.93 AR (0.44) ARGPR17UNGSERPINE1GHSR
SCHEMBL7998801 0.93 AR (0.44) ARGPR17UNGSERPINE1GHSR
SCHEMBL7988485 0.93 AR (0.44) ARGPR17UNGSERPINE1GHSR
SCHEMBL8004560 0.89 AR (0.47) ARGPR17UNGSERPINE1PSEN1
SCHEMBL7997292 0.86 AR (0.43) ARGPR17UNGSERPINE1ALDH1A1
SCHEMBL7998867 0.86 AR (0.43) ARGPR17UNGSERPINE1ALDH1A1
SCHEMBL7997659 0.86 GAA (0.41) ARGPR17UNGSERPINE1CNR2

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