SCHEMBL2772226

SCHEMBL2772226

O=C1c2ccc(O)c(O)c2C(=O)c2ccc(O)c(O)c21

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.86
MEN1 O00255 7/20 0.86
KMT2A Q03164 7/20 0.86
MAOA P21397 6/20 0.86
ALDH1A1 P00352 5/20 0.86
MAPK1 P28482 5/20 0.86
HPGD P15428 5/20 0.86
TDP1 Q9NUW8 5/20 0.86
ALOX15 P16050 4/20 0.86
HSD17B10 Q99714 4/20 0.86
KDM4E B2RXH2 3/20 0.86
CYP3A4 P08684 3/20 0.86
RECQL P46063 3/20 0.86
APEX1 P27695 2/20 0.86
THRB P10828 2/20 0.86
BRCA1 P38398 2/20 0.86
USP2 O75604 1/20 0.86
RAF1 P04049 1/20 0.86
TP53 P04637 1/20 0.86
CSNK2A2 P19784 1/20 0.86

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
Quinalizarin SCHEMBL29516323 0.93 MAOA (1.00) MAPTMEN1KMT2AMAOAALDH1A1
Quinalizarin SCHEMBL29437816 0.93 MAOA (1.00) MAPTMEN1KMT2AMAOAALDH1A1
Quinalizarin SCHEMBL138122 0.93 MAOA (1.00) MAPTMEN1KMT2AMAOAALDH1A1
Quinalizarin SCHEMBL20608650 0.93 MAOA (1.00) MAPTMEN1KMT2AMAOAALDH1A1
SCHEMBL6904748 0.92 MAPT (0.83) MAPTMEN1KMT2AMAOAALDH1A1
SCHEMBL11055115 0.91 MAPT (0.80) MAPTMEN1KMT2AMAOAALDH1A1
Athraquinones A SCHEMBL21114402 0.89 MAPT (1.00) MAPTMEN1KMT2AMAOAALDH1A1
Athraquinones A SCHEMBL18614 0.89 MAPT (1.00) MAPTMEN1KMT2AMAOAALDH1A1
SCHEMBL9350283 0.89 TTR (0.76) MAPTMEN1KMT2AMAOAALDH1A1
Athraquinones A SCHEMBL4972786 0.89 MAPT (1.00) MAPTMEN1KMT2AMAOAALDH1A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-58147486-A None JP disclosed
US-7811397-B2 Gas generating agent DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2010-10-12 US disclosed
US-20060065338-A1 Gas generating agent DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2006-03-30 US disclosed
US-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed
US-20020032256-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-14 US disclosed
EP-0320227-B1 Method of preventing polymer-scale formation SHINETSU CHEMICAL CO (JP) 1994-09-07 EP disclosed
US-4933399-A COATING INSIDE OF VESSEL WITH A CATIONIC DYE, DRYING, COATING WITH AN ANIONIC OR AMPHOTERIC POLYMER OR A HYDROXYL-CONTAINING COMPOUND IN A SOLVENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 1990-06-12 US disclosed
JP-S58147486-A LIQUID CRYSTAL DISPLAY ELEMENT SUMITOMO CHEM CO LTD 1983-09-02 JP disclosed
US-3932506-A FOR HYDROLYSIS OF ACRYLONITRILE TO ACRYLAMIDE NALCO CHEMICAL COMPANY (US) 1976-01-13 US disclosed