SCHEMBL711496

SCHEMBL711496

C=C([C]=O)Cc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 2/20 0.50
CES2 O00748 1/20 0.50
AKR1B1 P15121 1/20 0.50
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CTBP2 P56545 1/20 0.41
EPHX2 P34913 1/20 0.41
PAM P19021 2/20 0.39
FFAR1 O14842 1/20 0.39
TSHR P16473 2/20 0.39
ABCC4 O15439 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL9540539 0.78 KEAP1 (0.54) HDAC8HDAC6ALDH1A1MAPK1FFAR1
SCHEMBL6560456 0.77 CES1 (0.44) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL3604456 0.77 CES1 (0.50) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL6440598 0.75 HDAC1 (0.57) HDAC8HDAC6MAPK1L3MBTL1FFAR1
SCHEMBL5578204 0.74 CES1 (0.58) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL6471170 0.74 CYP2C19 (0.46) ALDH1A1TSHRLMNAGAAHTT
SCHEMBL10628617 0.73 CES1 (0.56) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL23093940 0.72 CES1 (0.45) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL12095508 0.72 CES1 (0.55) CES1CES2AKR1B1MEN1KMT2A
SCHEMBL2241627 0.72 CES1 (0.55) CES1CES2AKR1B1MEN1KMT2A

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7683073-B2 Isoquinoline-1,3,4-trione compounds, the synthetic method and the use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2010-03-23 US claimed
US-20060135557-A1 Isoquinoline-1,3,4-trione compounds, the synthetic method and the use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES 2006-06-22 US claimed
JP-7215970-A None JP disclosed
CN-103185907-B Lenticule optical sheet and use its back light unit and liquid crystal display SKC HAAS DISPLAY FILMS CO., LTD. (KR) 2016-03-16 CN disclosed
EP-1784431-B1 SUPPORTED METALLOCENE CATALYST, METHOD OF PREPARING THE CATALYST AND METHOD OF PREPARING POLYOLEFIN USING THE CATALYST LG CHEMICAL LTD (KR) 2015-01-07 EP disclosed
US-8926777-B2 Method for manufacturing high brightness optical sheet SKC HAAS DISPLAY FILMS CO., LTD. (KR) 2015-01-06 US disclosed
CN-103185907-A Micro optical lens and backlight unit and liquid display using micro optical lens Skc haas display film co ltd 2013-07-03 CN disclosed
CN-103105636-A Method for manufacturing high brightness optical sheet SKC HAAS DISPLAY FILMS CO LTD 2013-05-15 CN disclosed
US-20130078425-A1 METHOD FOR MANUFACTURING HIGH BRIGHTNESS OPTICAL SHEET SKC HAAS DISPLAY FILMS CO., LTD. (KR) 2013-03-28 US disclosed
US-8124557-B2 Supported metallocene catalyst, method of preparing the catalyst and method of preparing polyolefin using the catalyst LG CHEM, LTD. (KR) 2012-02-28 US disclosed
EP-1640367-B1 ISOQUINOLINE -1,3,4-TRIONE, THE SYNTHETIC METHOD AND THE USE THEREOF SHANGHAI INST MATERIA MEDICA (CN) 2011-02-09 EP disclosed
US-6110933-A AN ENZYME INHIBITOR TREATING PANCREATITIS, HEPATITIS, CHRONIC RENAL FAILURE, ENDOTOXIN SHOCK, GRAM-NEGATIVE SEPTIC SHOCK, ARTHRITIS, RESPIRATORY DISEASE, HEART DISEASE, ALLERGIC DISEASE, THROMBOSIS, ARTERIOSCLEROSIS, PAIN FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-08-29 US disclosed
WO-2000000220-A1 PHARMACEUTICAL COMPOSITION CONTAINING AN ESTER OR AMIDE PLA2 INHIBITOR FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-01-06 WO disclosed
EP-0741697-B1 AMINO ACID DERIVATIVES AND THEIR USE AS PHOSPHOLIPASE A2 INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 1999-09-15 EP disclosed
CN-1197450-A Esters and amides as phospholipase A2 inhibitors FUJISAWA PHARMACEUTICAL CO (JP) 1998-10-28 CN disclosed
EP-0854863-A1 ESTERS AND AMIDES AS PLA2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-07-29 EP disclosed
WO-1997003951-A1 ESTERS AND AMIDES AS PLA2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-06 WO disclosed
EP-0741697-A1 AMINO ACID DERIVATIVES AND THEIR USE AS PHOSPHOLIPASE A2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-13 EP disclosed
JP-H07215970-A INDAZOLESULFONYLUREA DERIVATIVE, USE THEREOF AND INTERMEDIATE FOR PRODUCING THE SAME KUMIAI CHEM IND CO LTD 1995-08-15 JP disclosed
WO-1995019959-A1 AMINO ACID DERIVATIVES AND THEIR USE AS PHOSPHOLIPASE A2 INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-07-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060135557-A1 Isoquinoline-1,3,4-trione compounds, the synthetic method and the use thereof APP, PSEN1, AIFM1 CES1 2677/4885CES2 4424/4885AKR1B1 855/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.