SCHEMBL3136962

SCHEMBL3136962

O=C(COCO)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.54
MAPT P10636 3/20 0.54
MAPK1 P28482 2/20 0.54
HPGD P15428 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
CYP3A4 P08684 1/20 0.54
ALOX15 P16050 1/20 0.54
CES1 P23141 1/20 0.54
KMT2A Q03164 1/20 0.54
L3MBTL1 Q9Y468 4/20 0.53
GSK3B P49841 3/20 0.50
ALDH1A1 P00352 2/20 0.50
PTPN1 P18031 2/20 0.50
TRPA1 O75762 1/20 0.50
HIF1A Q16665 1/20 0.50
NPC1 O15118 4/20 0.49
RAB9A P51151 4/20 0.49
CYP1A2 P05177 1/20 0.49

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
SCHEMBL864716 0.89 MAPT (0.61) TDP1MAPTMAPK1HPGDSMN1; SMN2
SCHEMBL27830157 0.83 L3MBTL1 (0.50) TDP1MAPTMAPK1HPGDSMN1; SMN2
Biphenyl SCHEMBL9787041 0.83 L3MBTL1 (0.58) TDP1MAPTMAPK1HPGDSMN1; SMN2
SCHEMBL3194897 0.83 TDP1 (0.54) TDP1MAPTMAPK1HPGDSMN1; SMN2
SCHEMBL5027527 0.81 MAPT (0.52) TDP1MAPTMAPK1HPGDSMN1; SMN2
SCHEMBL531300 0.81 NPC1 (0.53) TDP1MAPTMAPK1HPGDSMN1; SMN2
Phenol SCHEMBL11815882 0.81 TDP1 (0.52) TDP1MAPTMAPK1HPGDSMN1; SMN2
Catechol SCHEMBL9787047 0.81 ESR1 (0.57) TDP1MAPTMAPK1HPGDSMN1; SMN2
SCHEMBL5854020 0.81 MAPT (0.52) TDP1MAPTMAPK1HPGDSMN1; SMN2
SCHEMBL5191365 0.81 ALDH1A1 (0.59) TDP1MAPTMAPK1HPGDSMN1; 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0566780-B1 Heat-resistant resin composition KONISHI CO LTD (JP) 1998-03-11 EP claimed
EP-0566780-A1 Heat-resistant resin composition KONISHI CO., LTD. (JP) 1993-10-27 EP claimed
CN-120154091-A Production method of salt roasted chicken accessory by utilizing composite protease tenderization treatment 广东好味来食品有限公司 2025-06-17 CN disclosed
EP-2066408-B1 XANTHOXYLINE-BASED COMPOSITION AND COSMETIC USE THEREOF FABRE PIERRE DERMO COSMETIQUE (FR) 2010-07-14 EP disclosed
US-20100048729-A1 Composition based on xanthoxyline and its use in cosmetic PIERRE FABRE DERMO-COSMETIQUE (FR) 2010-02-25 US disclosed
EP-2066408-A2 XANTHOXYLINE-BASED COMPOSITION AND COSMETIC USE THEREOF Pierre Fabre Dermo-Cosmetique (FR) 2009-06-10 EP disclosed
WO-2008031940-A2 XANTHOXYLINE-BASED COMPOSITION AND COSMETIC USE THEREOF PIERRE FABRE DERMO-COSMETIQUE (FR) 2008-03-20 WO disclosed
US-6183934-B1 FOE USE IN FORMATION OF PATTERN OF INSULATION FILM, PASSIVATION FILM, .ALPHA.-RAY SHIELDING FILM, OPTICAL WAVEGUIDE KABUSHIKI KAISHA TOSHIBA (JP) 2001-02-06 US disclosed
EP-0566780-B1 Heat-resistant resin composition KONISHI CO LTD (JP) 1998-03-11 EP disclosed
EP-0566780-A1 Heat-resistant resin composition KONISHI CO., LTD. (JP) 1993-10-27 EP disclosed