SCHEMBL6582277

SCHEMBL6582277

COCC(=O)N(C)c1cc(NC(=O)C=Cc2ccccc2)ccc1C(=O)OC

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.60
RAB9A P51151 3/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.49
MMP1 P03956 8/20 0.49
MMP2 P08253 8/20 0.49
MMP9 P14780 8/20 0.49
EGFR P00533 7/20 0.49
MAOA P21397 4/20 0.46
MAOB P27338 4/20 0.46
TOP2A P11388 1/20 0.46
ACHE P22303 3/20 0.46
BCHE P06276 1/20 0.45
DEGS1 O15121 1/20 0.44
MAPT P10636 1/20 0.44
ALPG P10696 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL6582272 1.00 NPC1 (0.60) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL6583142 0.92 NPC1 (0.58) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL6583138 0.92 NPC1 (0.58) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL6581729 0.80 TDP1 (0.55) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL16221616 0.78 NPC1 (0.81) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL6581118 0.76 MAPT (0.37) RAB9AMEN1KMT2AEGFRMAPT
SCHEMBL12373212 0.76 NPC1 (0.70) NPC1RAB9AMEN1KMT2AL3MBTL1
SCHEMBL6579640 0.74 TP53 (0.42) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL6579642 0.74 TP53 (0.42) NPC1RAB9AMEN1KMT2AACHE
SCHEMBL6579489 0.74 GAA (0.51) MEN1KMT2AMAOAMAPTSMN1; SMN2

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
EP-0927718-B1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK & CHEMICALS (JP) 2004-02-25 EP disclosed
US-6271416-B1 O-(HYDROCARBONOXYACETAMIDO)BENZOIC ACID DERIVATIVES AS INTERMEDIATES DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-08-07 US disclosed
US-6136822-A ETHER, HYDROXY QUINOLINONE COMPOUNDS DAINIPPON INK AND CHEMICALS, INC. (JP) 2000-10-24 US disclosed
EP-0927718-A1 Quinolinone derivative, method for preparing the same, and anti-allergic agent DAINIPPON INK AND CHEMICALS, INC. (JP) 1999-07-07 EP disclosed