SCHEMBL6579513

SCHEMBL6579513

CCCCCCCCOCC(=O)N(C)c1cc(NC(C)=O)ccc1C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.45
HPGD P15428 3/20 0.40
RECQL P46063 1/20 0.40
CDK1 P06493 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CES2 O00748 1/20 0.37
POLB P06746 1/20 0.37
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
RORC P51449 1/20 0.36
HSD17B10 Q99714 2/20 0.35
MAPT P10636 1/20 0.35
NPC1 O15118 2/20 0.35
CASP1 P29466 2/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL6579559 0.93 HPGD (0.42) TDP1SMN1; SMN2HPGDRECQLMEN1
SCHEMBL6579888 0.93 HPGD (0.42) TDP1SMN1; SMN2HPGDRECQLMEN1
SCHEMBL6581702 0.88 HPGD (0.46) TDP1SMN1; SMN2HPGDRECQLMEN1
SCHEMBL6580873 0.88 TDP1 (0.56) TDP1SMN1; SMN2HPGDCDK1MEN1
SCHEMBL6579763 0.84 CA1 (0.44) HPGDKDM4EALDH1A1
SCHEMBL6578901 0.84 GAA (0.42) HPGDCES2POLBKDM4EALDH1A1
SCHEMBL6576914 0.84 TDP1 (0.44) TDP1SMN1; SMN2HPGDRECQLMEN1
SCHEMBL6579090 0.84 MAOA (0.38) SMN1; SMN2HPGDCES2KDM4EALDH1A1
SCHEMBL6581729 0.83 TDP1 (0.55) TDP1SMN1; SMN2HPGDCDK1MEN1
SCHEMBL6577324 0.81 KMT2A (0.39) TDP1SMN1; SMN2HPGDRECQLMEN1

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