SCHEMBL19784986

SCHEMBL19784986

C[C@H]1Cn2ncc(N3CC(O)CS3(=O)=O)c2CN1C(=O)OC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 3/20 0.32
▸ MAP4K4 O95819 1/20 0.31
▸ HDAC1 Q13547 1/20 0.30
▸ ELANE P08246 1/20 0.30
▸ SCN9A Q15858 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
SCHEMBL19785150 0.86 GPR119 (0.35) GPR119MAP4K4HDAC1ELANESCN9A
SCHEMBL19785073 0.85 GPR119 (0.31) GPR119MAP4K4
SCHEMBL19784991 0.85 GPR119 (0.33) GPR119MAP4K4HDAC1ELANESCN9A
SCHEMBL19784844 0.84 GPR119 (0.33) GPR119MAP4K4HDAC1ELANE
SCHEMBL19784864 0.83 GPR119 (0.33) GPR119MAP4K4HDAC1ELANE
SCHEMBL19784990 0.82 GPR119 (0.35) GPR119MAP4K4HDAC1ELANE
SCHEMBL19785167 0.82 RECQL (0.32) GPR119MAP4K4HDAC1
SCHEMBL29444262 0.81 MEN1 (0.35) HDAC1SCN9A
SCHEMBL19785006 0.81 MEN1 (0.35) HDAC1SCN9A
SCHEMBL17936895 0.81 GPR119 (0.37) GPR119MAP4K4HDAC1ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10683299-B2 Pyrazolopyrazine and triazolopyrazine compounds for the treatment of infectious diseases HOFFMANN LA ROCHE INC. (US) 2020-06-16 — — US disclosed
EP-3484886-B1 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE AND 6,7-DIHYDRO-4H-TRIAZOLO[1,5-A]PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES HOFFMANN LA ROCHE (CH) 2020-03-04 — — EP disclosed
US-20190248792-A1 NOVEL PYRAZOLOPYRAZINE AND TRIAZOLOPYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES HOFFMANN-LA ROCHE INC. (US) 2019-08-15 — — US disclosed
WO-2018011163-A1 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE AND 6,7-DIHYDRO-4H-TRIAZOLO[1,5-A]PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2018-01-18 — — 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 (2 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-20190248792-A1 NOVEL PYRAZOLOPYRAZINE AND TRIAZOLOPYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES CYP3A5, RRP15, HAVCR2 GPR119 766/4885MAP4K4 690/4885HDAC1 1649/4885
US-10683299-B2 Pyrazolopyrazine and triazolopyrazine compounds for the treatment of infectious diseases CYP3A5, RRP15, QDPR GPR119 1086/4885MAP4K4 878/4885HDAC1 1917/4885

“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.

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