⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30769070 | 1.00 | — | — | |
| SCHEMBL31444457 | 0.79 | CES2 (0.38) | — | |
| SCHEMBL1162776 | 0.79 | CES2 (0.38) | — | |
| SCHEMBL31444326 | 0.75 | TAAR1 (0.32) | — | |
| SCHEMBL1863530 | 0.75 | TAAR1 (0.32) | — | |
| SCHEMBL1125226 | 0.75 | ACHE (0.37) | — | |
| SCHEMBL5083110 | 0.74 | — | — | |
| SCHEMBL15530228 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL1256658 | 0.72 | — | — | |
| SCHEMBL4479531 | 0.72 | — | — |
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 228 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112409212-B | Preparation method of citalopram diol intermediate hydrobromide, citalopram diol intermediate hydrobromide and citalopram | 四川新迪医药化工有限公司 | 2023-03-14 | — | — | CN | claimed |
| CN-112409212-A | Preparation method of citalopram diol intermediate hydrobromide, citalopram diol intermediate hydrobromide and citalopram | 四川新迪医药化工有限公司 | 2021-02-26 | — | — | CN | claimed |
| CN-102503794-B | Method for preparing fluorine-containing substituted phenyl ketone | ASYMCHEM LAB TIANJIN CO LTD | 2014-01-01 | — | — | CN | claimed |
| CN-103044305-A | Preparation method of ezetimibe intermediate | SHANGSHAI SHYNDEC PHARMACEUTICAL CO LTD | 2013-04-17 | — | — | CN | claimed |
| CN-102675152-A | Preparation method of intermediate glycol of antidepressant citalopram | FUJIAN MATTER STRUCTURE | 2012-09-19 | — | — | CN | claimed |
| CN-102503794-A | Method for preparing fluorine-containing substituted phenyl ketone | ASYMCHEM LAB TIANJIN CO LTD | 2012-06-20 | — | — | CN | claimed |
| CN-102485726-A | Method for preparing 1-R-1'-spiro-(piperidine-4,4'-quinoline)-2'(3'-hydrogen)ketone | WUXI APPTEC CO LTD | 2012-06-06 | — | — | CN | claimed |
| US-6369265-B1 | HETEROCOUPLING REACTION, MIXING IN A LIQUID AN ARYL HALIDE, BONDING TO AROMATIC RINGS, GRIGNARD REACTION, METAL COMPOUND AND HETEROCYCLIC CARBENE | UNIVERSITY OF NEW ORLEANS RESEARCH & TECHNOLOGY FOUNDATION | 2002-04-09 | — | — | US | claimed |
| WO-2001066248-A2 | C-C AND C-N COUPLING CATALYST COMPRISING TRANSITION METAL AND CARBENE | UNIVERSITY OF NEW ORLEANS RESEARCH AND TECHNOLOGY FOUNDATION (US) | 2001-09-13 | — | — | WO | claimed |
| US-5623087-A | Method for preparation of optically active diarylalanines | NDSU-RESEARCH FOUNDATION (US) | 1997-04-22 | — | — | US | claimed |
| WO-1996027435-A1 | PROCESS FOR FORMING A BROMOMAGNESIUM TETRAKIS (FLUOROPHENYL) BORATE | AKZO NOBEL N.V. (NL) | 1996-09-12 | — | — | WO | claimed |
| US-5473036-A | Process for forming a bromomagnesium tetrakis (fluorophenyl) borate | AKZO NOBEL N.V. (NL) | 1995-12-05 | — | — | US | claimed |
| US-20250223296-A1 | HYDROXYMETHYL AZABICYCLO[2.2.1]HEPTANES AND MEDICAL USES THEREOF | ATROGI AB (SE) | 2025-07-10 | — | — | US | disclosed |
| EP-4496626-A1 | HYDROXYMETHYL AZABICYCLO[2.2.1]HEPTANES AND MEDICAL USES THEREOF | Atrogi AB (SE) | 2025-01-29 | — | — | EP | disclosed |
| WO-2024200777-A1 | SUBSTITUTED HYDROXYMETHYL PYRROLIDINES FOR USE IN THE TREATMENT OF HYPERGLYCAEMIA AND DISORDERS CHARACTERISED BY HYPERGLYCAEMIA | ATROGI AB (SE) | 2024-10-03 | — | — | WO | disclosed |
| CN-117983304-A | Catalyst containing tetraphosphine ligand for ethylene selective tetramerization and preparation method and application thereof | 华东理工大学 | 2024-05-07 | — | — | CN | disclosed |
| EP-0440082-A2 | Method for the conversion of fluorinated aromatic compounds using electrophiles | MERCK PATENT GmbH (DE) | 1991-08-07 | — | — | EP | disclosed |
| WO-1990010444-A1 | NOVEL HMG-CoA REDUCTASE INHIBITORS | RORER INTERNATIONAL (HOLDINGS), INC. (US) | 1990-09-20 | — | — | WO | disclosed |
| EP-0237916-A2 | 1,1-Disubstituted cyclopropane derivatives, processes for their preparation and their use as antimycotics or as intermediates | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-09-23 | — | — | EP | disclosed |
| US-4088644-A | N-Acyl-3-azetidinone | SCHERING-CORPORATION (US) | 1978-05-09 | — | — | US | disclosed |