SCHEMBL928328

SCHEMBL928328

C#CC1(O)CCCC(C)(C)C1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32

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
SCHEMBL30620787 0.86 ALDH1A1 (0.34) ALDH1A1
SCHEMBL26625926 0.86 ALDH1A1 (0.34) ALDH1A1
SCHEMBL4984709 0.77 ALDH1A1 (0.52) ALDH1A1
SCHEMBL129315 0.77
SCHEMBL19204512 0.76 PAX8 (0.30) ALDH1A1
SCHEMBL929080 0.75 ALDH1A1 (0.37) ALDH1A1
SCHEMBL7776760 0.74 ALDH1A1 (0.37) ALDH1A1
Cyanide SCHEMBL28015746 0.72
SCHEMBL26489 0.72
SCHEMBL1115158 0.70 ALDH1A1 (0.37) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8674143-B2 Synthesis of green ketone intermediate DSM IP ASSETS, B.V. (NL) 2014-03-18 US claimed
US-20120283476-A1 SYNTHESIS OF GREEN KETONE INTERMEDIATE DSM IP ASSETS, B.V. (NL) 2012-11-08 US claimed
WO-2010043522-A1 SYNTHESIS OF GREEN KETONE INTERMEDIATE DSM IP ASSETS B.V. (NL) 2010-04-22 WO claimed
EP-4149912-B1 PROCESS FOR PREPARING DIENE FIRMENICH & CIE (CH) 2025-04-30 EP disclosed
US-12103898-B2 Process for preparing diene FIRMENICH SA (CH) 2024-10-01 US disclosed
US-20230265025-A1 PROCESS FOR PREPARING DIENE FIRMENICH SA (CH) 2023-08-24 US disclosed
CN-115916732-A Process for preparing dienes 弗门尼舍有限公司 2023-04-04 CN disclosed
EP-4149912-A1 PROCESS FOR PREPARING DIENE Firmenich SA (CH) 2023-03-22 EP disclosed
EP-3122713-B1 PROCESS FOR THE PRODUCTION OF 1-(5,5-DIMETHYLCYCLOHEX-1-EN-1-YL)ETHANONE AND 1-(5,5-DIMETHYLCYCLOHEX-6-EN-1-YL)ETHANONE DSM IP ASSETS BV (NL) 2019-04-24 EP disclosed
EP-3122713-B1 PROCESS FOR THE PRODUCTION OF 1-(5,5-DIMETHYLCYCLOHEX-1-EN-1-YL)ETHANONE AND 1-(5,5-DIMETHYLCYCLOHEX-6-EN-1-YL)ETHANONE DSM IP ASSETS BV (NL) 2019-04-24 EP disclosed
CN-106132916-B The production technology of 1- (5,5- dimethyleyelohexane -1- alkene -1- bases) ethane ketone and 1- (5,5- dimethyleyelohexane -6- alkene -1- bases) ethane ketone 帝斯曼知识产权资产管理有限公司 2018-09-21 CN disclosed
EP-1496911-A1 USE OF A2A ADENOSINE RECEPTOR AGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2005-01-19 EP disclosed
EP-1434782-A2 2-PROPYNYL ADENOSINE ANALOGS HAVING A2A AGONIST ACTIVITY AND COMPOSITIONS THEREOF University of Virginia Patent Foundation (US) 2004-07-07 EP disclosed
WO-2004050602-A1 ESTERS AND THEIR USE IN PERFUMERY GIVAUDAN SA (CH) 2004-06-17 WO disclosed
WO-2003086408-A1 USE OF A2A ADENOSINE RECEPTOR AGONISTS FOR THE TREATMENT OF INFLAMMATORY DISEASES UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2003-10-23 WO disclosed
US-20030186926-A1 2-propynyl adenosine analogs having A2A agonist activity and compositions thereof NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-10-02 US disclosed
WO-2003029264-A2 2-PROPYNYL ADENOSINE ANALOGS HAVING A2A AGONIST ACTIVITY AND COMPOSITIONS THEREOF UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2003-04-10 WO disclosed
US-4289659-A CYCLOHEXANE DERIVATIVES FIRMENICH SA (CH) 1981-09-15 US disclosed
US-4264467-A Cyclic C6 compounds and their use in perfumes FIRMENICH SA (CH) 1981-04-28 US disclosed
US-4147672-A Cyclic C6 ketones in perfumes FIRMENICH SA (CH) 1979-04-03 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 (3 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-20230265025-A1 PROCESS FOR PREPARING DIENE FDFT1, SQLE, DHPS ALDH1A1 872/4885
US-12103898-B2 Process for preparing diene FDFT1, SQLE, DHPS ALDH1A1 872/4885
US-20030186926-A1 2-propynyl adenosine analogs having A2A agonist activity and compositions thereof ADORA2A, ADORA1, ADORA3 ALDH1A1 500/4885

“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.