SCHEMBL5539615

SCHEMBL5539615

O=C(O)c1cc(C(=O)O)c2ccccc2c1O

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.88
HPGD P15428 2/20 0.88
CYP2C9 P11712 2/20 0.88
TSHR P16473 1/20 0.88
ALOX12 P18054 1/20 0.88
ATIC P31939 1/20 0.88
THRB P10828 1/20 0.74
KDM4E B2RXH2 2/20 0.69
MEN1 O00255 2/20 0.69
MAPT P10636 2/20 0.69
KMT2A Q03164 2/20 0.69
ALDH1A1 P00352 2/20 0.69
PKM P14618 1/20 0.69
HTT P42858 1/20 0.69
HMGB1 P09429 1/20 0.67
CXCL12 P48061 1/20 0.67
MCL1 Q07820 8/20 0.61
LDHA P00338 1/20 0.57
POLB P06746 2/20 0.53
GPR35 Q9HC97 1/20 0.53

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
SCHEMBL9618861 0.87 HSD17B10 (0.74) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL2113477 0.87 HSD17B10 (0.73) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL317180 0.85 THRB (1.00) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL9618746 0.85 HSD17B10 (0.66) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL3387263 0.85 THRB (0.71) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL485003 0.82 HSD17B10 (0.67) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL485235 0.82 HSD17B10 (0.67) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL12818517 0.82 HSD17B10 (0.67) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL22213017 0.82 HSD17B10 (0.67) HSD17B10HPGDCYP2C9TSHRALOX12
SCHEMBL6036418 0.82 HSD17B10 (0.61) HSD17B10HPGDCYP2C9TSHRALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605142-B1 Copper, nickel, or manganese carboxylate and colorant; ink jet printing AVECIA LIMITED (GB) 2003-08-12 US claimed
CN-1373795-A Chemical composition for ink AVECIA LTD (GB) 2002-10-09 CN claimed
EP-1153093-A1 CHEMICAL COMPOSITION FOR INK Avecia Limited (GB) 2001-11-14 EP claimed
WO-2000037574-A1 CHEMICAL COMPOSITION FOR INK AVECIA LIMITED (GB) 2000-06-29 WO claimed
US-8282202-B2 Aqueous inkjet printing fluid compositions EASTMAN KODAK COMPANY (US) 2012-10-09 US disclosed
US-8282202-B2 Aqueous inkjet printing fluid compositions EASTMAN KODAK COMPANY (US) 2012-10-09 US disclosed
US-20120105549-A1 AQUEOUS INKJET PRINTING FLUID COMPOSITIONS QUALEX INC. 2012-05-03 US disclosed
US-20120105549-A1 AQUEOUS INKJET PRINTING FLUID COMPOSITIONS QUALEX INC. 2012-05-03 US disclosed
US-7179401-B2 Thermotropic liquid-crystalline polymer KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) 2007-02-20 US disclosed
EP-1422256-B1 THERMOTROPIC LIQUID-CRYSTAL POLYMER UENO SEIYAKU OYO KENKYUJO KK (JP) 2006-08-02 EP disclosed
US-20040256599-A1 Thermotorpic liquid-crystal polymer UENO FINE CHEMICALS INDUSTRY, LTD. (JP) 2004-12-23 US disclosed
US-6605142-B1 Copper, nickel, or manganese carboxylate and colorant; ink jet printing AVECIA LIMITED (GB) 2003-08-12 US disclosed
CN-1373795-A Chemical composition for ink AVECIA LTD (GB) 2002-10-09 CN disclosed
EP-1153093-A1 CHEMICAL COMPOSITION FOR INK Avecia Limited (GB) 2001-11-14 EP disclosed
WO-2000037574-A1 CHEMICAL COMPOSITION FOR INK AVECIA LIMITED (GB) 2000-06-29 WO disclosed