SCHEMBL1323798

SCHEMBL1323798

CCOC(=O)[C@]1(N)CC(=O)NC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
OPRM1 P35372 3/20 0.38
CYP19A1 P11511 3/20 0.37
ATM Q13315 1/20 0.37
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
KMT2A Q03164 1/20 0.36
HPGD P15428 2/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
BRD4 O60885 1/20 0.35
OPRD1 P41143 2/20 0.34
OPRK1 P41145 2/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL498176 1.00 POLB (0.46) POLBTSHRNPSR1OPRM1CYP19A1
SCHEMBL560921 1.00 POLB (0.46) POLBTSHRNPSR1OPRM1CYP19A1
Hydrochloric Acid SCHEMBL560903 0.98 POLB (0.45) POLBTSHRNPSR1OPRM1CYP19A1
Hydrochloric Acid SCHEMBL560902 0.98 POLB (0.45) POLBTSHRNPSR1OPRM1CYP19A1
SCHEMBL1322859 0.77 POLB (0.44) POLBTSHRNPSR1OPRM1CYP19A1
SCHEMBL13744265 0.76 BRD4 (0.55) POLBTSHROPRM1GAASMN1; SMN2
Hydrochloric Acid SCHEMBL1323790 0.76 POLB (0.43) POLBTSHRNPSR1OPRM1CYP19A1
SCHEMBL20737258 0.75 POLB (0.49) POLBTSHROPRM1ATMGAA
Hydrochloric Acid SCHEMBL26670487 0.73 POLB (0.47) POLBTSHROPRM1ATMSMN1; SMN2
SCHEMBL29095734 0.72 POLB (0.46) POLBTSHROPRM1ATMSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-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 POLB 1981/4885TSHR 2500/4885NPSR1 1374/4885

“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.