SCHEMBL1322984

SCHEMBL1322984

NC1(C(=O)O)CC(=O)NC1=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.36
GRM2 Q14416 2/20 0.35
GRM3 Q14832 2/20 0.35
TSHR P16473 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GRM8 O00222 1/20 0.32
GRM6 O15303 1/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
ITGB3 P05106 1/20 0.31
ITGB1 P05556 1/20 0.31
ITGAV P06756 1/20 0.31
ITGA4 P13612 1/20 0.31
GRM4 Q14833 1/20 0.31
NSD2 O96028 1/20 0.30
BACE1 P56817 1/20 0.30

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
SCHEMBL4356813 1.00 CYP19A1 (0.36) CYP19A1GRM2GRM3TSHRNPSR1
SCHEMBL1325877 1.00 CYP19A1 (0.36) CYP19A1GRM2GRM3TSHRNPSR1
SCHEMBL1323798 0.71 POLB (0.46) CYP19A1TSHRNPSR1
SCHEMBL498176 0.71 POLB (0.46) CYP19A1TSHRNPSR1
SCHEMBL560921 0.71 POLB (0.46) CYP19A1TSHRNPSR1
SCHEMBL13090519 0.70 MAPT (0.42)
Hydrochloric Acid SCHEMBL560903 0.70 POLB (0.45) CYP19A1TSHRNPSR1
Hydrochloric Acid SCHEMBL560902 0.70 POLB (0.45) CYP19A1TSHRNPSR1
SCHEMBL4637001 0.69
SCHEMBL1324255 0.68 TSHR (0.31) CYP19A1TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8415487-B2 Process for preparing (3R)-2′-(4-bromo-2-fluorobenzyl)spiro-[pyrrolidine-3,4′(1′H)-pyrrolo[1,2-A]pyrazine]-1′,2,3′,5(2H′)-tetraone DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-04-09 US disclosed
US-8415487-B2 Process for preparing (3R)-2′-(4-bromo-2-fluorobenzyl)spiro-[pyrrolidine-3,4′(1′H)-pyrrolo[1,2-A]pyrazine]-1′,2,3′,5(2H′)-tetraone DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-04-09 US disclosed
US-8389742-B2 3-hydrazino-2,5-dioxopyrrolidine-3-carboxylate, process for production of the same, and use of the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-03-05 US disclosed
US-20120010405-A1 OPTICALLY ACTIVE 3-AMINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATE, PROCESS FOR PRODUCTION OF THE COMPOUND, AND USE OF THE COMPOUND TANAKA DAISUKE (JP) 2012-01-12 US disclosed
US-8058456-B2 Optically active 3-amino-2,5-dioxopyrrolidine-3-carboxylate, process for production of the compound, and use of the compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-15 US disclosed
US-8058456-B2 Optically active 3-amino-2,5-dioxopyrrolidine-3-carboxylate, process for production of the compound, and use of the compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-15 US disclosed
US-8058456-B2 Optically active 3-amino-2,5-dioxopyrrolidine-3-carboxylate, process for production of the compound, and use of the compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-11-15 US disclosed
US-8003808-B2 3-hydrazino-2,5-dioxopyrrolidine-3-carboxylates, process for production of the same, and use of the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-08-23 US disclosed
US-20110201807-A1 3-HYDRAZINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATE, PROCESS FOR PRODUCTION OF THE SAME, AND USE OF THE SAME TANAKA DAISUKE 2011-08-18 US disclosed
US-20090286980-A1 OPTICALLY ACTIVE 3-AMINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATE, PROCESS FOR PRODUCTION OF THE COMPOUND, AND USE OF THE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-11-19 US disclosed
US-20090286980-A1 OPTICALLY ACTIVE 3-AMINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATE, PROCESS FOR PRODUCTION OF THE COMPOUND, AND USE OF THE COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-11-19 US disclosed
US-20090253917-A1 3-HYDRAZINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATES, PROCESS FOR PRODUCTION OF THE SAME, AND USE OF THE SAME DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-10-08 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-20090253917-A1 3-HYDRAZINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATES, PROCESS FOR PRODUCTION OF THE SAME, AND USE OF THE SAME SLC5A1, TERT, CBR3 CYP19A1 3751/4885GRM2 4178/4885GRM3 2551/4885
US-20090286980-A1 OPTICALLY ACTIVE 3-AMINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATE, PROCESS FOR PRODUCTION OF THE COMPOUND, AND USE OF THE COMPOUND REN, GPR119, RANBP1 CYP19A1 2942/4885GRM2 3574/4885GRM3 2414/4885
US-20120010405-A1 OPTICALLY ACTIVE 3-AMINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATE, PROCESS FOR PRODUCTION OF THE COMPOUND, AND USE OF THE COMPOUND REN, GPR119, RANBP1 CYP19A1 2942/4885GRM2 3574/4885GRM3 2414/4885
US-20110201807-A1 3-HYDRAZINO-2,5-DIOXOPYRROLIDINE-3-CARBOXYLATE, PROCESS FOR PRODUCTION OF THE SAME, AND USE OF THE SAME CBR3, TERT, NOX4 CYP19A1 3717/4885GRM2 4477/4885GRM3 2924/4885

“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.