SCHEMBL1661965

SCHEMBL1661965

CC(C)(C)OC(=O)NC1CC(=O)OC1=O

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.55
NFKB1 P19838 5/20 0.50
NFKB2 Q00653 5/20 0.50
RELA Q04206 5/20 0.50
BTK Q06187 1/20 0.39
EPHX2 P34913 1/20 0.37
CTSK P43235 2/20 0.36
KDM1A O60341 1/20 0.36

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
SCHEMBL8355012 1.00 GAA (0.55) GAANFKB1NFKB2RELABTK
SCHEMBL1661966 1.00 GAA (0.55) GAANFKB1NFKB2RELABTK
SCHEMBL10054766 0.86 GAA (0.51) GAANFKB1NFKB2RELABTK
SCHEMBL7801965 0.84 GAA (0.37) GAANFKB1NFKB2RELA
SCHEMBL7403132 0.84 GAA (0.37) GAANFKB1NFKB2RELA
SCHEMBL7403136 0.84 GAA (0.37) GAANFKB1NFKB2RELA
SCHEMBL29217279 0.84 GAA (0.52) GAANFKB1NFKB2RELABTK
SCHEMBL19021605 0.84 GAA (0.52) GAANFKB1NFKB2RELABTK
SCHEMBL14159811 0.79 GAA (0.51) GAANFKB1NFKB2RELABTK
SCHEMBL14308598 0.78 GAA (0.47) GAANFKB1NFKB2RELABTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116283990-B Application of substituted pyrrolidone compound as tumor necrosis factor inhibitor 沈阳药科大学 2023-12-15 CN disclosed
CN-116283990-A Application of substituted pyrrolidone compound as tumor necrosis factor inhibitor 沈阳药科大学 2023-06-23 CN disclosed
US-8735582-B2 Method for producing carboxylic anhydride and arylboronic acid compound NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-05-27 US disclosed
US-8735582-B2 Method for producing carboxylic anhydride and arylboronic acid compound NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-05-27 US disclosed
EP-2306994-B1 S1P1 RECEPTOR AGONISTS AND USE THEREOF AMGEN INC (US) 2013-08-14 EP disclosed
EP-1963319-B1 HETEROARYLPYRROLOPYRIDINONES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2012-04-11 EP disclosed
EP-1963319-B1 HETEROARYLPYRROLOPYRIDINONES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2012-04-11 EP disclosed
US-20120035373-A1 PROCESSES OF PRODUCING GLUTAMIC ACID COMPOUNDS AND PRODUCTION INTERMEDIATES THEREFORE AND NOVEL INTERMEDIATE FOR THE PROCESSES AJINOMOTO CO. INC (JP) 2012-02-09 US disclosed
US-20110319620-A1 METHOD FOR PRODUCING CARBOXYLIC ANHYDRIDE AND ARYLBORONIC ACID COMPOUND NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2011-12-29 US disclosed
EP-2306994-A1 S1P1 RECEPTOR AGONISTS AND USE THEREOF Amgen, Inc (US) 2011-04-13 EP disclosed
EP-1444202-B1 NOVEL METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2008-10-15 EP disclosed
EP-1963319-A1 HETEROARYLPYRROLOPYRIDINONES ACTIVE AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2008-09-03 EP disclosed
US-7390909-B2 Processes of producing glutamic acid compounds and production intermediates therefore and novel intermediate for the processes AJINOMOTO CO., INC. (JP) 2008-06-24 US disclosed
US-20080091032-A1 PROCESSES OF PRODUCING GLUTAMIC ACID COMPOUNDS AND PRODUCTION INTERMEDIATES THEREFORE AND NOVEL INTERMEDIATE FOR THE PROCESSES AJINOMOTO CO. INC (JP) 2008-04-17 US disclosed
WO-2007071621-A1 HETEROARYLPYRROLOPYRIDINONES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2007-06-28 WO disclosed
US-20070142415-A1 Heteroarylpyrrolopyridinones active as kinase inhibitors PHARMACIA ITALIA S.P.A. (IT) 2007-06-21 US disclosed
US-20070142415-A1 Heteroarylpyrrolopyridinones active as kinase inhibitors PHARMACIA ITALIA S.P.A. (IT) 2007-06-21 US disclosed
EP-0638068-A1 PROCESS FOR THE MANUFACTURE OF (S)-3-AMINO-1-SUBSTITUTED-PYRROLIDINES WARNER-LAMBERT COMPANY (US) 1995-02-15 EP disclosed
WO-1993022283-A1 PROCESS FOR THE MANUFACTURE OF (S)-3-AMINO-1-SUBSTITUTED-PYRROLIDINES WARNER-LAMBERT COMPANY (US) 1993-11-11 WO disclosed
US-5250704-A Process for the manufacture of (S)-3-amino-1-substituted-pyrrolidines WARNER-LAMBERT COMPANY (US) 1993-10-05 US 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 (4 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-20110319620-A1 METHOD FOR PRODUCING CARBOXYLIC ANHYDRIDE AND ARYLBORONIC ACID COMPOUND CA6, CA9, APEH GAA 70/4885NFKB1 1476/4885NFKB2 1120/4885
US-20120035373-A1 PROCESSES OF PRODUCING GLUTAMIC ACID COMPOUNDS AND PRODUCTION INTERMEDIATES THEREFORE AND NOVEL INTERMEDIATE FOR THE PROCESSES GLUL, MON2, GRIK5 GAA 195/4885NFKB1 4398/4885NFKB2 4642/4885
US-20070142415-A1 Heteroarylpyrrolopyridinones active as kinase inhibitors MAP3K1, MAP3K19, MAP3K3 GAA 3299/4885NFKB1 2470/4885NFKB2 2280/4885
US-20080091032-A1 PROCESSES OF PRODUCING GLUTAMIC ACID COMPOUNDS AND PRODUCTION INTERMEDIATES THEREFORE AND NOVEL INTERMEDIATE FOR THE PROCESSES GLUL, MON2, GRIK5 GAA 195/4885NFKB1 4398/4885NFKB2 4642/4885

“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.