SCHEMBL21392151

SCHEMBL21392151

COC(=O)C1(c2ccnc(SC)n2)CCOCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 1/20 0.37
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ PDE4B Q07343 3/20 0.35
▸ PDE4A P27815 1/20 0.35
▸ PDE4C Q08493 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ PDE3B Q13370 1/20 0.35
▸ PDE11A Q9HCR9 1/20 0.35
▸ ANO1 Q5XXA6 1/20 0.34
▸ CTPS1 P17812 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL22758510 0.88 FFAR4 (0.36) FFAR4ALOX15PIK3CA
SCHEMBL24848905 0.88 FFAR4 (0.34) FFAR4PDE4BPDE4APDE4CPDE4D
SCHEMBL22758556 0.86 FFAR4 (0.39) FFAR4PDE4BPDE4APDE4CPDE4D
SCHEMBL22758512 0.85 FFAR4 (0.35) FFAR4ALOX15PIK3CA
SCHEMBL29142075 0.85 FFAR4 (0.38) FFAR4PDE4BPDE4APDE4CPDE4D
Lithium SCHEMBL30725900 0.85 FFAR4 (0.38) FFAR4PDE4BPDE4APDE4CPDE4D
Lithium Ion SCHEMBL22749301 0.84 FFAR4 (0.35) FFAR4PDE4BCTPS1ALDH1A1KDM4E
SCHEMBL24895767 0.83 FFAR4 (0.34) FFAR4PDE4BPDE4APDE4CPDE4D
SCHEMBL24849318 0.83 FFAR4 (0.34) FFAR4CYP2C19PDE4BHTTPIK3CA
SCHEMBL30882869 0.82 CYP2C19 (0.38) CYP3A4CYP2C9PKMCYP2C19ANO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12466810-B2 N-(5-(6-ethoxypyrazin-2-yl)pyridin-2-yl)-4-(2-(methylsulfonamido)pyrimidin-4-yl) tetrahydro-2H-pyran-4-carboxamide derivatives and related compounds as human CTPS1 inhibitors for the treatment of proliferative diseases STEP PHARMA S.A.S. (FR) 2025-11-11 — — US disclosed
US-20250282756-A1 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors STEP PHARMA S.A.S. (FR) 2025-09-11 — — US disclosed
US-12371419-B2 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors STEP PHARMA S.A.S. (FR) 2025-07-29 — — US disclosed
US-20250066324-A1 AMINOPYRIMIDINE/PYRAZINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2025-02-27 — — US disclosed
US-11987573-B2 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors STEP PHARMA S.A.S. (FR) 2024-05-21 — — US disclosed
CN-114008039-B Compounds as human CTPS1 inhibitors for the treatment of proliferative diseases 斯泰普制药股份公司 2024-01-16 — — CN disclosed
EP-3768674-B1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S A S (FR) 2024-01-03 — — EP disclosed
CN-112839938-B Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors 斯泰普制药股份公司 2023-07-07 — — CN disclosed
US-20230192673-A1 Compounds STEP PHARMA S.A.S. (FR) 2023-06-22 — — US disclosed
US-20230192673-A1 Compounds STEP PHARMA S.A.S. (FR) 2023-06-22 — — US disclosed
US-20210387965-A1 Compounds STEP PHARMA S.A.S. (FR) 2021-12-16 — — US disclosed
US-20210387965-A1 Compounds STEP PHARMA S.A.S. (FR) 2021-12-16 — — US disclosed
CN-112839938-A Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors 斯泰普制药股份公司 2021-05-25 — — CN disclosed
WO-2021053403-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2021-03-25 — — WO disclosed
WO-2021053402-A2 COMPOUNDS STEP PHARMA S.A.S. (FR) 2021-03-25 — — WO disclosed
US-20210024507-A1 Compounds STEP PHARMA S A S (FR) 2021-01-28 — — US disclosed
US-20210024507-A1 Compounds STEP PHARMA S A S (FR) 2021-01-28 — — US disclosed
WO-2020245664-A1 N-(5-(6-ETHOXYPYRAZIN-2-YL)PYRIDIN-2-YL)-4-(2-(METHYLSULFONAMIDO)PYRIMIDIN-4-YL) TETRAHYDRO-2H-PYRAN-4-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS HUMAN CTPS1 INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISEASES STEP PHARMA S.A.S. (FR) 2020-12-10 — — WO disclosed
WO-2020245664-A1 N-(5-(6-ETHOXYPYRAZIN-2-YL)PYRIDIN-2-YL)-4-(2-(METHYLSULFONAMIDO)PYRIMIDIN-4-YL) TETRAHYDRO-2H-PYRAN-4-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS HUMAN CTPS1 INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISEASES STEP PHARMA S.A.S. (FR) 2020-12-10 — — WO disclosed
WO-2019180244-A1 AMINOPYRIMIDINE DERIVATIVES AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2019-09-26 — — 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 (8 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-12371419-B2 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors CTPS1, CTPS2, TYMS FFAR4 4492/4885CYP3A4 950/4885CYP2C9 1251/4885
US-20250282756-A1 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors CTPS1, CTPS2, TYMS FFAR4 4512/4885CYP3A4 1020/4885CYP2C9 1398/4885
US-20250066324-A1 AMINOPYRIMIDINE/PYRAZINE DERIVATIVES AS CTPS1 INHIBITORS CTPS1, CTPS2, TYMS FFAR4 4492/4885CYP3A4 950/4885CYP2C9 1251/4885
US-20210024507-A1 Compounds CYP1A1, UGT1A1, CYP1A2 FFAR4 4454/4885CYP3A4 13/4885CYP2C9 15/4885
US-20230192673-A1 Compounds CYP1A1, UGT1A1, CYP1A2 FFAR4 4454/4885CYP3A4 13/4885CYP2C9 15/4885
US-20210387965-A1 Compounds CYP1A1, UGT1A1, CYP1B1 FFAR4 4429/4885CYP3A4 19/4885CYP2C9 16/4885
US-11987573-B2 Aminopyrimidine/pyrazine derivatives as CTPS1 inhibitors CTPS1, CTPS2, TYMS FFAR4 4492/4885CYP3A4 950/4885CYP2C9 1251/4885
US-12466810-B2 N-(5-(6-ethoxypyrazin-2-yl)pyridin-2-yl)-4-(2-(methylsulfonamido)pyrimidin-4-yl) tetrahydro-2H-pyran-4-carboxamide derivatives and related compounds as human CTPS1 inhibitors for the treatment of proliferative diseases CTPS1, CTPS2, TYMS FFAR4 3901/4885CYP3A4 2397/4885CYP2C9 1677/4885

“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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