SCHEMBL2761208

SCHEMBL2761208

CCOC(=O)c1ccc2cc3ccccc3cc2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.57
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
CA7 P43166 3/20 0.57
CA9 Q16790 3/20 0.57
CA14 Q9ULX7 3/20 0.57
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
MAPT P10636 2/20 0.55
RAB9A P51151 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 2/20 0.55
NPC1 O15118 1/20 0.55
GLA P06280 1/20 0.55
GAA P10253 1/20 0.55
HPGD P15428 1/20 0.55
ATM Q13315 1/20 0.55
HCRTR1 O43613 1/20 0.54

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
SCHEMBL30684671 0.95 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL571295 0.95 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL9979785 0.95 CA12 (0.62) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL27783226 0.93 CA12 (0.57) CA12CA1CA2CA7CA9
Hydrochloric Acid SCHEMBL27804731 0.93 CA12 (0.57) CA12CA1CA2CA7CA9
SCHEMBL707407 0.91 CA12 (0.67) CA12CA1CA2CA7CA9
SCHEMBL1960994 0.89 CA12 (0.65) CA12CA1CA2CA7CA9
SCHEMBL6667524 0.85 MAPT (0.64) CA12CA1CA2CA7CA9
SCHEMBL15724963 0.84 CA12 (0.59) CA12CA1CA2CA7CA9
SCHEMBL16259100 0.84 CA12 (0.59) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170253575-A1 SOLID ACID CATALYST AND METHOD FOR PRODUCING OXIDE DAICEL CORPORATION (JP) 2017-09-07 US disclosed
CN-106660032-A Solid acid catalyst and method for producing oxide 株式会社大赛璐 2017-05-10 CN disclosed
US-9447013-B2 Method for producing oxide DAICEL CORPORATION (JP) 2016-09-20 US disclosed
US-20160159722-A1 METHOD FOR PRODUCING OXIDE DAICEL CORPORATION (JP) 2016-06-09 US disclosed
EP-3023407-A1 METHOD FOR PRODUCING OXIDE Daicel Corporation (JP) 2016-05-25 EP disclosed
CN-105392763-A Method for producing oxide DAICEL CORP 2016-03-09 CN disclosed
EP-1238704-B1 Catalyst comprising a cyclic imide compound and process for producing organic compounds using the catalyst DAICEL CHEM (JP) 2015-01-21 EP disclosed
EP-2248792-B1 PROCESS FOR PRODUCTION OF OXYGEN-CONTAINING ORGANIC COMPOUND DAICEL CHEM (JP) 2013-11-27 EP disclosed
EP-1433527-B1 CATALYSTS COMPRISED OF N-SUBSTITUTED CYCLIC IMIDES AND PROCESSES FOR PREPARING ORGANIC COMPOUNDS WITH THE CATALYSTS DAICEL CHEM (JP) 2013-11-06 EP disclosed
CN-101925563-B Process for production of oxygen-containing organic compound DAICEL CHEM 2013-10-09 CN disclosed
CN-1395507-A Catalysts comprising N-substituted cyclic imides and processes for prepairing organic compounds with catalysts DAICEL CHEM (JP) 2003-02-05 CN disclosed
US-20030013603-A1 Catalyst comprising n-substituted cylic imides and processes for preparing organic compounds with the catalyst DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-01-16 US disclosed
US-6486265-B1 Method for surface modification of molded article of plastic and method for modifying polymer DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-11-26 US disclosed
US-20020128149-A1 Catalyst comprising a cyclic imide compound and process for producing organic compounds using the catalyst DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-09-12 US disclosed
EP-1238704-A2 Catalyst comprising a cyclic imide compound and process for producing organic compounds using the catalyst Daicel Chemical Industries, Ltd. (JP) 2002-09-11 EP disclosed
US-6403521-B1 FOR OXIDATION, NITRATION, CARBOXYLATION, SULFONATION; NO EXHAUST GAS TREATMENT; 6-TRIFLUOROMETHYL-L-HYDROXY BENZOTRIAZOLE; 3-HYDROXY-4-OXO-1,2,3-BENZOTRIAZINE TO OXIDIZE FLUORENE TO FLUORENONE; ADAMANTANE TO ADAMANTANOL DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-11 US disclosed
EP-1120438-A1 METHOD FOR SURFACE MODIFICATION OF MOLDED ARTICLE OF PLASTIC AND METHOD FOR MODIFYING POLYMER Daicel Chemical Industries, Ltd. (JP) 2001-08-01 EP disclosed
US-6229023-B1 N-OXY OR HYDROXY CYCLIC IMIDE OXIDATION CATALYST DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2001-05-08 US disclosed
EP-1085015-A2 Catalyst comprising a nitrogen-containing heterocylic compound Daicel Chemical Industries, Ltd. (JP) 2001-03-21 EP disclosed
EP-0990631-A1 PROCESS FOR COOXIDIZING ORGANIC COMPOUNDS, PROCESS FOR PRODUCING EPOXY COMPOUNDS AND PROCESS FOR PRODUCING ESTERS OR LACTONES Daicel Chemical Industries, Ltd. (JP) 2000-04-05 EP 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 (3 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-20160159722-A1 METHOD FOR PRODUCING OXIDE HAO2, NOXO1, NOX4 CA12 2986/4885CA1 1580/4885CA2 1213/4885
US-20170253575-A1 SOLID ACID CATALYST AND METHOD FOR PRODUCING OXIDE HAO2, HAO1, SCO2 CA12 328/4885CA1 88/4885CA2 577/4885
US-20020128149-A1 Catalyst comprising a cyclic imide compound and process for producing organic compounds using the catalyst NOX4, POR, NOX1 CA12 891/4885CA1 416/4885CA2 633/4885

“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.