⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL564758 | 0.75 | — | — | |
| SCHEMBL17598891 | 0.70 | — | — | |
| SCHEMBL38188 | 0.70 | — | — | |
| SCHEMBL3261343 | 0.70 | — | — | |
| SCHEMBL10535002 | 0.67 | — | — | |
| Potassium SCHEMBL30607080 | 0.67 | — | — | |
| SCHEMBL4229276 | 0.67 | — | — | |
| Lithium SCHEMBL30271121 | 0.67 | — | — | |
| Ammonia Solution, Strong SCHEMBL10617791 | 0.67 | — | — | |
| SCHEMBL10524134 | 0.67 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112020520-B | Method for producing allyl monomer copolymer having polar group | 国立大学法人东京大学 | 2023-03-10 | — | — | CN | disclosed |
| WO-2012021455-A1 | CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF | REMPEX PHARMACEUTICALS, INC. (US) | 2012-02-16 | — | — | WO | disclosed |
| US-7232915-B2 | Process for the synthesis of 1,3-diols | WARNER-LAMBERT COMPANY (US) | 2007-06-19 | — | — | US | disclosed |
| EP-1054860-B1 | PROCESS FOR THE SYNTHESIS OF 1,3-DIOLS | PFIZER IRELAND PHARMACEUTICALS (IE) | 2007-04-25 | — | — | EP | disclosed |
| US-6962994-B2 | Process for the synthesis of 1,3-diols | WARNER-LAMBERT COMPANY, LLC (US) | 2005-11-08 | — | — | US | disclosed |
| US-20050197500-A1 | Process for the synthesis of 1,3-diols | BOSCH ROBERT L (US) | 2005-09-08 | — | — | US | disclosed |
| US-20040006231-A1 | Process for the synthesis of 1,3-diols | BOSCH ROBERT LEE (US) | 2004-01-08 | — | — | US | disclosed |
| US-6596879-B2 | Beta hydroxy ketone treated with trialkylborane or dialkylalkoxyborane followed by recovery and reuse of alkylborane | WARNER-LAMBERT COMPANY | 2003-07-22 | — | — | US | disclosed |
| US-20020161021-A1 | Process for the synthesis of 1,3-diols | BOSCH ROBERT LEE (US) | 2002-10-31 | — | — | US | disclosed |
| US-6433213-B1 | REDUCTION USING BORON COMPOUND | WARNER-LAMBERT COMPANY | 2002-08-13 | — | — | US | disclosed |
| EP-1054860-A1 | PROCESS FOR THE SYNTHESIS OF 1,3-DIOLS | Warner-Lambert Export Limited (IE) | 2000-11-29 | — | — | EP | disclosed |
| WO-1999032434-A1 | PROCESS FOR THE SYNTHESIS OF 1,3-DIOLS | WARNER-LAMBERT EXPORT LIMITED (IE) | 1999-07-01 | — | — | WO | disclosed |
| US-4870212-A | ALKYL BORATE AND ORGANOLITHIUM | ALDRICH-BORANES, INC. (US) | 1989-09-26 | — | — | US | disclosed |
| US-4870177-A | PYROLYSIS OF LITHIUM ORGANYLBORATES | ALDRICH-BORANES, INC. (US) | 1989-09-26 | — | — | US | disclosed |
| US-4855506-A | Process for lithium mono- and diorganylborohydrides | ALDRICH-BORANES, INC. (US) | 1989-08-08 | — | — | US | disclosed |
| US-4772751-A | EASILY SEPARATED FROM BY-PRODUCTS | ALDRICH-BORANES, INC. (US) | 1988-09-20 | — | — | US | disclosed |