SCHEMBL8000766

SCHEMBL8000766

CCCCn1c(=O)c(OC(C)C)c(OCC=C(C)C)c2ccc(N)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORA P35398 4/20 0.34
RORC P51449 4/20 0.34
RORB Q92753 4/20 0.34
NPC1 O15118 5/20 0.34
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 1/20 0.34
RGS12 O14924 1/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 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
KMT2A Q03164 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TYMS P04818 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 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
SCHEMBL7997796 0.96 PSEN1 (0.38) NPC1MEN1USP2POLBKMT2A
SCHEMBL7999044 0.96 PSEN1 (0.38) NPC1MEN1USP2POLBKMT2A
SCHEMBL7988286 0.92 TDP1 (0.40) ALDH1A1MEN1KMT2APSEN1KDM4E
SCHEMBL7988284 0.92 TDP1 (0.40) ALDH1A1MEN1KMT2APSEN1KDM4E
SCHEMBL7998913 0.90 ALDH1A1 (0.36) ALDH1A1MEN1KMT2ALMNAACHE
SCHEMBL7999587 0.89 NPC1 (0.37) RORARORCRORBNPC1ALDH1A1
SCHEMBL8001105 0.89 CYP1B1 (0.38) RORARORCRORBNPC1ALDH1A1
SCHEMBL7999141 0.89 TDP1 (0.39) ALDH1A1MEN1KMT2ATYMSPSEN1
SCHEMBL7999135 0.89 TDP1 (0.39) ALDH1A1MEN1KMT2ATYMSPSEN1
SCHEMBL7998004 0.89 TDP1 (0.39) ALDH1A1MEN1KMT2ATYMSPSEN1

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