SCHEMBL7988276

SCHEMBL7988276

CCCCCCCCNc1ccc2c(OCCCC)c(OCCCCCCCC)c(=O)n(C)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.39
ADRA2A P08913 1/20 0.38
UNG P13051 2/20 0.36
AR P10275 1/20 0.36
TERT O14746 1/20 0.36
ATM Q13315 1/20 0.35
GSK3B P49841 2/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TP53 P04637 1/20 0.34
RAD52 P43351 1/20 0.34
CNR2 P34972 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 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
SCHEMBL7998318 0.99 ABL1 (0.40) ABL1ADRA2AUNGARTERT
SCHEMBL8001104 0.98 AR (0.38) ABL1ADRA2AUNGARTERT
SCHEMBL7988945 0.98 AR (0.38) ABL1ADRA2AUNGARTERT
SCHEMBL8000560 0.97 AR (0.39) ABL1ADRA2AUNGARTERT
SCHEMBL8001557 0.94 AR (0.40) ADRA2AARATMNPC1RAB9A
SCHEMBL7998926 0.93 ABL1 (0.38) ABL1ADRA2AARTERTATM
SCHEMBL7997315 0.91 AR (0.37) ABL1ADRA2AARATMGSK3B
SCHEMBL8004435 0.91 AR (0.37) ABL1ADRA2AARATMGSK3B
SCHEMBL8004028 0.91 ABL1 (0.34) ABL1ADRA2AARTERTATM
SCHEMBL8004491 0.91 ABL1 (0.34) ABL1ADRA2AARTERTATM

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