SCHEMBL6581491

SCHEMBL6581491

C=CCCOCC(=O)N(C)c1cc(NC(=O)C=Cc2ccc(O)c(O)c2)ccc1C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 12/20 0.46
MMP2 P08253 12/20 0.46
MMP9 P14780 12/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
TTR P02766 1/20 0.41
DPP4 P27487 1/20 0.41
MAPT P10636 2/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 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
SCHEMBL6581489 1.00 MMP1 (0.46) MMP1MMP2MMP9L3MBTL1BCHE
SCHEMBL6579902 0.86 MMP1 (0.46) MMP1MMP2MMP9L3MBTL1ACHE
SCHEMBL6579907 0.86 MMP1 (0.46) MMP1MMP2MMP9L3MBTL1ACHE
SCHEMBL6579930 0.83 TDP1 (0.41) MAPTTP53KMT2AMEN1ALDH1A1
SCHEMBL6581198 0.83 MMP1 (0.43) MMP1MMP2MMP9L3MBTL1MAPT
SCHEMBL6581205 0.83 MMP1 (0.43) MMP1MMP2MMP9L3MBTL1MAPT
SCHEMBL6577324 0.80 KMT2A (0.39) MAPTTP53NPC1KMT2AMEN1
SCHEMBL7974963 0.79 ALDH1A1 (0.47) L3MBTL1BCHEACHEMAPTTP53
SCHEMBL7974960 0.79 ALDH1A1 (0.47) L3MBTL1BCHEACHEMAPTTP53
SCHEMBL7980787 0.77 ALDH1A1 (0.46) L3MBTL1BCHEACHEMAPTTP53

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