SCHEMBL6581483

SCHEMBL6581483

CCOC(=O)c1ccc(NC(C)=O)cc1N(C)C(=O)COc1ccc(O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.46
KMT2A Q03164 5/20 0.45
MEN1 O00255 3/20 0.45
LMNA P02545 2/20 0.45
CYP1A2 P05177 1/20 0.45
HSD17B10 Q99714 2/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 4/20 0.44
RAB9A P51151 3/20 0.44
TSHR P16473 1/20 0.42
MAPK10 P53779 1/20 0.42
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
CA14 Q9ULX7 2/20 0.41
MMP13 P45452 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL6581134 0.92 MAPT (0.49) TDP1KMT2AMEN1LMNACYP1A2
SCHEMBL6579566 0.91 TSHR (0.50) TDP1KMT2AMEN1LMNACYP1A2
SCHEMBL6579875 0.87 KMT2A (0.41) TDP1KMT2AMEN1TP53MAPT
SCHEMBL6579745 0.83 LMNA (0.48) KMT2AMEN1LMNACYP1A2HSD17B10
SCHEMBL6576624 0.82 TSHR (0.50) TDP1KMT2AMEN1LMNACYP1A2
SCHEMBL6581702 0.82 HPGD (0.46) TDP1KMT2AMEN1LMNACYP1A2
SCHEMBL6576914 0.82 TDP1 (0.44) TDP1KMT2AMEN1LMNACYP1A2
SCHEMBL6578819 0.79 TDP1 (0.41) TDP1KMT2AMEN1LMNATP53
SCHEMBL6581391 0.79 SMN1; SMN2 (0.48) TDP1KMT2AMEN1LMNACYP1A2
Ethyl Benzoate SCHEMBL27551058 0.79 MAPT (0.40) KMT2AMEN1LMNACYP1A2HSD17B10

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