SCHEMBL7997498

SCHEMBL7997498

CC=C(CC)Oc1c(OC)c(=O)n(C)c2cc(NCCCC)ccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.35
ATM Q13315 2/20 0.35
PGR P06401 3/20 0.34
RORA P35398 1/20 0.34
RORC P51449 1/20 0.34
RORB Q92753 1/20 0.34
CRBN Q96SW2 1/20 0.33
CYP1A2 P05177 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
LMNA P02545 2/20 0.32
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
MAPK1 P28482 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
KEAP1 Q14145 1/20 0.32
PLEC Q15149 1/20 0.32
NFE2L2 Q16236 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL7997504 0.91 AR (0.35) ARATMPGRRORARORC
SCHEMBL8001306 0.89 AR (0.34) ARATMCRBNCYP1A2LMNA
SCHEMBL8002092 0.89 AR (0.34) ARATMCRBNCYP1A2SMN1; SMN2
SCHEMBL7998193 0.87 ABL1 (0.34) ARATMTP53KDM4EHPGD
SCHEMBL7997676 0.85 AR (0.32) ARATMSMN1; SMN2LMNAHTT
SCHEMBL8000840 0.85 GSK3B (0.38) ARATMKDM4EHPGDHSD17B10
SCHEMBL8001266 0.84 MAOB (0.38) SMN1; SMN2HTTMEN1KMT2AMAPT
SCHEMBL8001531 0.84 TERT (0.32) ARATMLMNAHTTMEN1
SCHEMBL7988841 0.83 KDM4E (0.41) ARATMPGRRORARORC
SCHEMBL8004435 0.82 AR (0.37) ARATMPGRRORARORC

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 3 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