SCHEMBL17782032

SCHEMBL17782032

NCc1cc(Cl)ccc1Cn1c(=S)[nH]c(=O)c2[nH]ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 20/20 1.00
▸ TPO P07202 20/20 1.00
▸ CYP3A4 P08684 2/20 1.00
▸ KCNH2 Q12809 2/20 0.75

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
SCHEMBL17802433 0.91 MPO (0.84) MPOTPOCYP3A4KCNH2
SCHEMBL30601242 0.87 MPO (0.78) MPOTPOCYP3A4KCNH2
SCHEMBL30601245 0.86 MPO (0.76) MPOTPOCYP3A4KCNH2
SCHEMBL17782024 0.86 MPO (1.00) MPOTPOCYP3A4KCNH2
SCHEMBL17782081 0.84 MPO (0.73) MPOTPOCYP3A4KCNH2
SCHEMBL27117957 0.84 MPO (0.84) MPOTPOCYP3A4KCNH2
SCHEMBL17782041 0.84 MPO (1.00) MPOTPOCYP3A4KCNH2
SCHEMBL30601269 0.84 MPO (0.72) MPOTPOCYP3A4KCNH2
SCHEMBL17782029 0.84 MPO (1.00) MPOTPOCYP3A4KCNH2
SCHEMBL30601274 0.83 MPO (0.71) MPOTPOCYP3A4KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12569489-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase ASTRAZENECA AB (SE) 2026-03-10 — — US claimed
US-20240335446-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2024-10-10 — — US claimed
US-11975004-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase ASTRAZENECA AB (SE) 2024-05-07 — — US claimed
US-20210228585-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2021-07-29 — — US claimed
US-11000525-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase ASTRAZENECA AB (SE) 2021-05-11 — — US claimed
EP-3227294-B1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2019-08-14 — — EP claimed
US-20190076432-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2019-03-14 — — US claimed
EP-3227294-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE Astrazeneca AB (SE) 2017-10-11 — — EP claimed
US-9616063-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase ASTRAZENECA AB (SE) 2017-04-11 — — US claimed
WO-2016087338-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2016-06-09 — — WO claimed
US-20160152623-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2016-06-02 — — US claimed
US-12569489-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase ASTRAZENECA AB (SE) 2026-03-10 — — US disclosed
US-20240335446-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2024-10-10 — — US disclosed
US-11975004-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase ASTRAZENECA AB (SE) 2024-05-07 — — US disclosed
WO-2024042119-A1 PROCESS FOR THE PREPARATION OF SUBSTITUTED PYRROLOPYRIMIDINES AND INTERMEDIATES ASTRAZENECA AB (SE) 2024-02-29 — — WO disclosed
US-9616063-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase ASTRAZENECA AB (SE) 2017-04-11 — — US disclosed
WO-2016087338-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2016-06-09 — — WO disclosed
WO-2016087338-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-D]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2016-06-09 — — WO disclosed
US-20160152623-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2016-06-02 — — US disclosed
US-20160152623-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE ASTRAZENECA AB (SE) 2016-06-02 — — 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 (7 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-20160152623-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE MPO, GPX1, TH MPO 1/4885TPO 21/4885CYP3A4 825/4885
US-11000525-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase MPO, GPX1, TH MPO 1/4885TPO 21/4885CYP3A4 825/4885
US-20240335446-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE MPO, GPX1, TH MPO 1/4885TPO 21/4885CYP3A4 825/4885
US-20190076432-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE MPO, GPX1, TH MPO 1/4885TPO 21/4885CYP3A4 825/4885
US-20210228585-A1 1-[2-(AMINOMETHYL)BENZYL]-2-THIOXO-1,2,3,5-TETRAHYDRO-4H-PYRROLO[3,2-d]PYRIMIDIN-4-ONES AS INHIBITORS OF MYELOPEROXIDASE MPO, GPX1, TH MPO 1/4885TPO 21/4885CYP3A4 825/4885
US-11975004-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase MPO, GPX1, TH MPO 1/4885TPO 21/4885CYP3A4 825/4885
US-12569489-B2 1-[2-(aminomethyl)benzyl]-2-thioxo-1,2,3,5-tetrahydro-4H-pyrrolo[3,2-d]pyrimidin-4-ones as inhibitors of myeloperoxidase MPO, EPX, LPO MPO 1/4885TPO 4/4885CYP3A4 2717/4885

“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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