SCHEMBL7999999

SCHEMBL7999999

CCCCCCOc1c(OC(C)C)c(=O)n(CCCCCC)c2cc(NC(C)=O)ccc12

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.48
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
PSEN1 P49768 2/20 0.40
PSEN2 P49810 2/20 0.40
APH1B Q8WW43 2/20 0.40
NCSTN Q92542 2/20 0.40
APH1A Q96BI3 2/20 0.40
PSENEN Q9NZ42 2/20 0.40
KDM4E B2RXH2 1/20 0.40
RGS12 O14924 1/20 0.40
MAPT P10636 2/20 0.40
RORC P51449 1/20 0.39
TYMS P04818 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL7999253 0.98 NPC1 (0.48) NPC1MEN1KMT2APSEN1PSEN2
SCHEMBL7989479 0.91 NPC1 (0.49) NPC1MEN1KMT2APSEN1PSEN2
SCHEMBL8001246 0.91 NPC1 (0.53) NPC1MEN1KMT2APSEN1PSEN2
SCHEMBL8004039 0.90 NPC1 (0.45) NPC1MEN1KMT2APSEN1PSEN2
SCHEMBL8004120 0.90 NPC1 (0.53) NPC1MEN1KMT2APSEN1PSEN2
SCHEMBL7989064 0.89 NPC1 (0.51) NPC1MEN1KMT2APSEN1PSEN2
SCHEMBL8000946 0.89 NPC1 (0.50) NPC1MEN1KMT2APSEN1PSEN2
SCHEMBL8076784 0.89 NPC1 (0.50) NPC1MEN1KMT2ATYMS
SCHEMBL7989239 0.87 NPC1 (0.51) NPC1MEN1KMT2APSEN1PSEN2
SCHEMBL8001651 0.87 NPC1 (0.48) NPC1MEN1KMT2APSEN1PSEN2

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