Sugi Predict

Sugi Predict / Compounds / SCHEMBL441242

SCHEMBL441242

SCHEMBL441242

COC(=O)c1nc(-c2cncc(C)c2)cnc1N1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 2/20 0.47
▸ HCRTR1 O43613 2/20 0.46
▸ HCRTR2 O43614 2/20 0.46
▸ ALDH1A1 P00352 3/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ DYRK1A Q13627 1/20 0.41
▸ OPRK1 P41145 2/20 0.39
▸ NOS1 P29475 1/20 0.39
▸ GAK O14976 1/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ ROCK1 Q13464 1/20 0.39

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
SCHEMBL7876773 0.88 LRRK2 (0.47) LRRK2HCRTR1HCRTR2ALDH1A1KDM4E
SCHEMBL10133630 0.81 LRRK2 (0.52) LRRK2HCRTR1HCRTR2ALDH1A1KDM4E
SCHEMBL439302 0.78 HCRTR1 (0.73) HCRTR1HCRTR2
SCHEMBL451554 0.73 HCRTR1 (0.46) HCRTR1HCRTR2ATM
SCHEMBL438348 0.73 ATM (0.41) HCRTR1HCRTR2OPRK1ATM
SCHEMBL438304 0.72 HCRTR2 (0.61) HCRTR1HCRTR2ALDH1A1SMN1; SMN2ATM
SCHEMBL3755666 0.72 NOS1 (0.69) LRRK2NOS1GAKMTOR
SCHEMBL440917 0.71 HCRTR2 (0.44) HCRTR1HCRTR2RAB9AATM
SCHEMBL19406805 0.71 IRAK4 (0.51) HCRTR1HCRTR2ALDH1A1KDM4ENPC1
SCHEMBL30414390 0.70 CYP11B1 (0.53) LRRK2HCRTR1HCRTR2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3684184-B1 HERBICIDALLY ACTIVE PYRIDYL-/PYRIMIDYL-PYRAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2023-06-21 — — EP claimed
US-20220144801-A1 HERBICIDALLY ACTIVE PYRIDYL-/PYRIMIDYL-PYRAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2022-05-12 — — US claimed
US-11229205-B2 Herbicidally active pyridyl-/pyrimidyl-pyrazine derivatives SYNGENTA PARTICIPATIONS AG (CH) 2022-01-25 — — US claimed
US-20200267984-A1 Herbicidally Active Pyridyl-/Pyrimidyl-Pyrazine Derivatives SYNGENTA PARTICIPATIONS AG (CH) 2020-08-27 — — US claimed
EP-3684184-A1 HERBICIDALLY ACTIVE PYRIDYL-/PYRIMIDYL-PYRAZINE DERIVATIVES Syngenta Participations AG (CH) 2020-07-29 — — EP claimed
WO-2019057723-A1 HERBICIDALLY ACTIVE PYRIDYL-/PYRIMIDYL-PYRAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2019-03-28 — — WO claimed
CN-118317774-A Pharmaceutical compositions comprising quinazoline compounds 安斯泰来制药株式会社 2024-07-09 — — CN disclosed
US-20240166661-A1 Spiropiperidine Derivatives CEPHALON LLC 2024-05-23 — — US disclosed
US-11878982-B2 Spiropiperidine derivatives 89BIO LTD (IL) 2024-01-23 — — US disclosed
CN-117088900-A Carbazole compound and organic electroluminescent device thereof 长春海谱润斯科技股份有限公司 2023-11-21 — — CN disclosed
CN-116323603-A Method for labeling nucleic acids 剑桥实业有限公司 2023-06-23 — — CN disclosed
EP-3684184-B1 HERBICIDALLY ACTIVE PYRIDYL-/PYRIMIDYL-PYRAZINE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2023-06-21 — — EP disclosed
CN-116157409-A Diaryl phosphine oxide derivatives 片山化学工业株式会社 2023-05-23 — — CN disclosed
EP-2205734-A2 C5a BINDING NUCLEIC ACIDS Noxxon Pharma AG (DE) 2010-07-14 — — EP disclosed
EP-2195293-A2 CYCLOPTOPYL AMIDE DERIVATIVES AstraZeneca AB (SE) 2010-06-16 — — EP disclosed
WO-2010062245-A1 SPIROCYCLOBUTYL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2010-06-03 — — WO disclosed
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives ASTRAZENECA AB (SE) 2010-05-27 — — US disclosed
WO-2009040113-A2 C5a BINDING NUCLEIC ACIDS NOXXON PHARMA AG (DE) 2009-04-02 — — WO disclosed
US-20090076020-A1 Cyclopropyl Amide Derivatives 978 ASTRAZENECA AB (SE) 2009-03-19 — — US disclosed
WO-2009024823-A2 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2009-02-26 — — 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 (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-11878982-B2 Spiropiperidine derivatives FASN, FADS2, SCD5 LRRK2 3832/4885HCRTR1 2188/4885HCRTR2 2307/4885
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives HRH3, HRH4, HRH2 LRRK2 136/4885HCRTR1 14/4885HCRTR2 9/4885
US-20200267984-A1 Herbicidally Active Pyridyl-/Pyrimidyl-Pyrazine Derivatives DDT, HPD, PLPBP LRRK2 3537/4885HCRTR1 3302/4885HCRTR2 3828/4885
US-20240166661-A1 Spiropiperidine Derivatives FASN, FADS2, SCD5 LRRK2 3832/4885HCRTR1 2188/4885HCRTR2 2307/4885
US-20220144801-A1 HERBICIDALLY ACTIVE PYRIDYL-/PYRIMIDYL-PYRAZINE DERIVATIVES DDT, HPD, PLPBP LRRK2 3537/4885HCRTR1 3302/4885HCRTR2 3828/4885
US-11229205-B2 Herbicidally active pyridyl-/pyrimidyl-pyrazine derivatives DDT, HPD, PLPBP LRRK2 3537/4885HCRTR1 3302/4885HCRTR2 3828/4885
US-20090076020-A1 Cyclopropyl Amide Derivatives 978 HRH4, HRH2, HRH3 LRRK2 966/4885HCRTR1 20/4885HCRTR2 15/4885

“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.