⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6594452 | 1.00 | — | — | |
| SCHEMBL7218328 | 1.00 | — | — | |
| SCHEMBL6436476 | 0.88 | — | — | |
| SCHEMBL11359187 | 0.79 | — | — | |
| SCHEMBL137154 | 0.78 | — | — | |
| SCHEMBL102759 | 0.78 | — | — | |
| SCHEMBL483199 | 0.78 | — | — | |
| SCHEMBL5909422 | 0.77 | ALDH1A1 (0.61) | — | |
| SCHEMBL5909423 | 0.77 | ALDH1A1 (0.61) | — | |
| SCHEMBL5909480 | 0.74 | ALDH1A1 (0.57) | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1198749-A | Control of molecular weight and end-group functionality in polymers | COMMW SCIENT IND RES ORG (AU) | 1998-11-11 | — | — | CN | claimed |
| CN-116063345-B | Phosphonic acid group monomer and preparation method thereof | 中国石油化工股份有限公司 | 2024-08-06 | — | — | CN | disclosed |
| CN-116063626-B | Anti-calcium shrinkage and expansion agent and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-05-07 | — | — | CN | disclosed |
| CN-116064016-B | Scale inhibition anti-swelling shrinkage swelling agent and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-04-05 | — | — | CN | disclosed |
| CN-116064016-A | Scale inhibition anti-swelling shrinkage swelling agent and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-05-05 | — | — | CN | disclosed |
| CN-116063626-A | Anti-calcium shrinkage and expansion agent and preparation method and application thereof | 中国石油化工股份有限公司 | 2023-05-05 | — | — | CN | disclosed |
| CN-116063345-A | Phosphonic acid group monomer and preparation method thereof | 中国石油化工股份有限公司 | 2023-05-05 | — | — | CN | disclosed |
| EP-0915867-B1 | THIENYLCYCLOHEXANE DERIVATIVES FOR THIENYLCYCLOHEXYL SYNTHESIS | SOD CONSEILS RECH APPLIC (FR) | 2004-10-06 | — | — | EP | disclosed |
| US-6620815-B1 | Selective antagonists for human alpha 1A receptors; benign prostatic hyperplasia, impotency, cardiac arrhythmia treatment; anticholesterol agents; intraocular pressure reduction | SYNAPTIC PHARMACEUTICAL CORPORATION | 2003-09-16 | — | — | US | disclosed |
| EP-0988295-A4 | HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF | SYNAPTIC PHARMA CORP (US) | 2003-08-13 | — | — | EP | disclosed |
| CN-1116308-C | Control of molecular weight and end-group functionality in polymers | COMMW SCIENT IND RES ORG (AU) | 2003-07-30 | — | — | CN | disclosed |
| US-6159990-A | Oxazolidinones as α1A receptor antagonists | SYNAPTIC PHARMACEUTICAL CORPORATION (US) | 2000-12-12 | — | — | US | disclosed |
| US-6107495-A | REACTING SPECIFIED 1-(2- OR 3-THIENYL) CYCLOHEXANES WITH A 1,5-DIHALOPENTANE TO FORM CYCLIC (THIENYLCYCLOHEXYL)AMINES SUCH AS 2-ALKYL-(3-THIENYL)CYCLOHEXYL PIPERIDINE; USE AS INTERMEDIATES TO RADIOACTIVE LABELLED MOLECULES | SOCIETE D'EXPANSION SCIENTIFIQUE EXPANSIA (FR) | 2000-08-22 | — | — | US | disclosed |
| EP-0988295-A1 | HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF | SYNAPTIC PHARMACEUTICAL CORPORATION (US) | 2000-03-29 | — | — | EP | disclosed |
| EP-0915867-A1 | THIENYLCYCLOHEXANE DERIVATIVES FOR THIENYLCYCLOHEXYL SYNTHESIS | Société de Conseils de Recherches et d'Applications Scientifiques ( S.C.R.A.S.) (FR) | 1999-05-19 | — | — | EP | disclosed |
| WO-1998057940-A1 | HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF | SYNAPTIC PHARMACEUTICAL CORPORATION (US) | 1998-12-23 | — | — | WO | disclosed |
| CN-1202161-A | Macrocyclic compounds as metalloproteinase inhibitors | DU PONT MERCK PHARMA (US) | 1998-12-16 | — | — | CN | disclosed |
| CN-1198749-A | Control of molecular weight and end-group functionality in polymers | COMMW SCIENT IND RES ORG (AU) | 1998-11-11 | — | — | CN | disclosed |
| WO-1998003498-A1 | THIENYLCYCLOHEXANE DERIVATIVES FOR THIENYLCYCLOHEXYL SYNTHESIS | SOCIETE D'EXPANSION SCIENTIFIQUE EXPANSIA (FR) | 1998-01-29 | — | — | WO | disclosed |
| US-3997669-A | ANTIINFLAMMATORY | CIBA-GEIGY CORPORATION (US) | 1976-12-14 | — | — | US | disclosed |