Propyne

Propyne

SCHEMBL23142192

C#CC.CC(C)(C)OC(N)=O

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.34
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CTSK P43235 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
SCHEMBL3094 0.87
SCHEMBL30234788 0.87 DGAT1 (0.42) DGAT1MAOAMAOBLMNAHSD17B10
SCHEMBL28902273 0.87 DGAT1 (0.42) DGAT1MAOAMAOBLMNAHSD17B10
SCHEMBL28325001 0.87 DGAT1 (0.42) DGAT1MAOAMAOBLMNAHSD17B10
Acetonitrile SCHEMBL20679756 0.85 CTSK (0.36) DGAT1MAOAMAOBLMNAHSD17B10
Hydrochloric Acid SCHEMBL8549932 0.84 DGAT1 (0.40) DGAT1MAOAMAOBLMNAHSD17B10
SCHEMBL28616368 0.84
SCHEMBL30702219 0.84
Methylamine SCHEMBL25305181 0.84 DGAT1 (0.40) DGAT1MAOAMAOBLMNAHSD17B10
Potassium SCHEMBL29411221 0.84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12157726-B2 P-phenylenediamine derivative as potassium channel regulator and preparation method and medical application thereof SHANGHAI ZHIMENG BIOPHARMA INC. 2024-12-03 US disclosed
EP-3798220-B1 P-PHENYLENEDIAMINE DERIVATIVE AS POTASSIUM CHANNEL REGULATOR AND PREPARATION METHOD AND MEDICAL APPLICATION THEREOF SHANGHAI ZHIMENG BIOPHARMA INC (CN) 2023-08-23 EP disclosed
CN-113372345-B Deuterated heterocyclic kinase inhibitors 山东轩竹医药科技有限公司 2022-08-16 CN disclosed
US-20220227721-A1 P-PHENYLENEDIAMINE DERIVATIVE AS POTASSIUM CHANNEL REGULATOR AND PREPARATION METHOD AND MEDICAL APPLICATION THEREOF SHANGHAI ZHIMENG BIOPHARMA INC. (CN) 2022-07-21 US disclosed
US-11365181-B2 P-phenylenediamine derivative as potassium channel regulator and preparation method and medical application thereof SHANGHAI ZHIMENG BIOPHARMA INC. (CN) 2022-06-21 US disclosed
CN-112574211-B Heterocyclic kinase inhibitors 山东轩竹医药科技有限公司 2022-06-14 CN disclosed
CN-112574179-B DNA-PK inhibitors 山东轩竹医药科技有限公司 2022-05-10 CN disclosed
CN-110511220-B P-diaminobenzene derivatives as potassium channel modulators, process for their preparation and their use in medicine 上海挚盟医药科技有限公司 2022-04-01 CN disclosed
CN-113372345-A Deuterated heterocyclic kinase inhibitors 山东轩竹医药科技有限公司 2021-09-10 CN disclosed
US-20210163429-A1 P-PHENYLENEDIAMINE DERIVATIVE AS POTASSIUM CHANNEL REGULATOR AND PREPARATION METHOD AND MEDICAL APPLICATION THEREOF SHANGHAI ZHIMENG BIOPHARMA INC. (CN) 2021-06-03 US disclosed
CN-101437829-A Bisadenosine compounds as adenosine A2A receptor agonists NOVARTIS AG (CH) 2009-05-20 CN disclosed
CN-101296906-A (hetero)aryl compounds with MCH antagonistic activity and medicaments comprising these compounds BOEHRINGER INGELHEIM INT (DE) 2008-10-29 CN disclosed
CN-101277700-A Pyrimidine compounds as serotonin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2008-10-01 CN disclosed
CN-101180297-A Alkynyl pyrrolopyrimidines and related analogs as hsp90-inhibitors CONFORMA THERAPEUTICS CORP (US) 2008-05-14 CN disclosed
CN-101048418-A PI 3-kinase BOEHRINGER INGELHEIM INT (DE) 2007-10-03 CN disclosed
CN-101023064-A Enantiomerically pure aminoheteroaryl compounds as protein kinase inhibitors AGOURON PHARMA (US) 2007-08-22 CN disclosed
CN-101014603-A Compounds and methods for inhibiting mitosis by inhibiting aurora kinase MILLENNIUM PHARM INC (US) 2007-08-08 CN disclosed
CN-1777427-A Aminoheteroaryl compounds as protein kinase inhibitors SUGEN INC (US) 2006-05-24 CN disclosed
CN-1726218-A Pyrrolopyrimidine derivatives PFIZER PROD INC (US) 2006-01-25 CN disclosed
CN-1241176-A Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER (US) 2000-01-12 CN 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 (4 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-12157726-B2 P-phenylenediamine derivative as potassium channel regulator and preparation method and medical application thereof KCNJ2, KCNN2, KCNH2 DGAT1 2754/4885MAOA 1302/4885MAOB 1320/4885
US-20220227721-A1 P-PHENYLENEDIAMINE DERIVATIVE AS POTASSIUM CHANNEL REGULATOR AND PREPARATION METHOD AND MEDICAL APPLICATION THEREOF KCNJ2, KCNN2, KCNH2 DGAT1 2754/4885MAOA 1302/4885MAOB 1320/4885
US-11365181-B2 P-phenylenediamine derivative as potassium channel regulator and preparation method and medical application thereof KCNJ2, KCNN2, KCNH2 DGAT1 2737/4885MAOA 1299/4885MAOB 1329/4885
US-20210163429-A1 P-PHENYLENEDIAMINE DERIVATIVE AS POTASSIUM CHANNEL REGULATOR AND PREPARATION METHOD AND MEDICAL APPLICATION THEREOF KCNJ2, KCNN2, KCNH2 DGAT1 2737/4885MAOA 1299/4885MAOB 1329/4885

“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.