SCHEMBL7997572

SCHEMBL7997572

CCCCOc1c(OC)c(=O)n(CCCC)c2cc(N)ccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.42
MEN1 O00255 2/20 0.42
USP2 O75604 2/20 0.42
ALDH1A1 P00352 2/20 0.42
POLB P06746 2/20 0.42
KMT2A Q03164 2/20 0.42
RGS12 O14924 1/20 0.42
RAB9A P51151 1/20 0.42
BLM P54132 1/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DYRK1A Q13627 1/20 0.41
PGR P06401 7/20 0.40
RORA P35398 5/20 0.40
RORC P51449 5/20 0.40
RORB Q92753 5/20 0.40
TDP1 Q9NUW8 3/20 0.39

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
SCHEMBL7997054 0.95 MEN1 (0.43) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL7998838 0.95 MEN1 (0.41) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL7997472 0.95 MEN1 (0.43) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL7988312 0.95 NPC1 (0.42) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL8002162 0.94 MEN1 (0.44) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL7997758 0.93 MEN1 (0.43) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL7988049 0.93 PGR (0.43) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL7988526 0.92 ALDH1A1 (0.42) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL7998531 0.91 MEN1 (0.43) NPC1MEN1USP2ALDH1A1POLB
SCHEMBL7999225 0.91 MEN1 (0.41) NPC1MEN1USP2ALDH1A1POLB

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