SCHEMBL6576540

SCHEMBL6576540

CCCCOCC(=O)N(C)c1ccc(C(=O)Oc2ccccc2)cc1C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.40
MEN1 O00255 5/20 0.40
MAPT P10636 8/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TSHR P16473 1/20 0.39
HPGD P15428 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HSP90AA1 P07900 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
THRB P10828 1/20 0.38
TP53 P04637 2/20 0.38
NPC1 O15118 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
RAB9A P51151 1/20 0.38
POLB P06746 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
SCHEMBL6576677 0.90 CYP1A2 (0.43) KMT2AMEN1TDP1L3MBTL1TSHR
SCHEMBL27551068 0.87 ALDH1A1 (0.51) KMT2AMEN1MAPTTDP1L3MBTL1
SCHEMBL6577290 0.82 MAPT (0.43) KMT2AMEN1MAPTTDP1L3MBTL1
SCHEMBL6579625 0.81 TSHR (0.45) KMT2AMEN1MAPTTDP1L3MBTL1
SCHEMBL6578832 0.75 TSHR (0.47) KMT2AMEN1MAPTTDP1L3MBTL1
SCHEMBL27474980 0.74 TSHR (0.49) KMT2AMEN1TDP1L3MBTL1TSHR
SCHEMBL27489931 0.73 NPC1 (0.46) KMT2AMEN1MAPTTDP1TSHR
SCHEMBL6582116 0.73 TSHR (0.50) KMT2AMEN1TDP1L3MBTL1TSHR
SCHEMBL6579455 0.73 MEN1 (0.41) KMT2AMEN1MAPTTDP1L3MBTL1
SCHEMBL7996804 0.73 CYP1A2 (0.43) KMT2AMEN1MAPTTDP1L3MBTL1

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