⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31741248 | 1.00 | — | — | |
| SCHEMBL4733761 | 1.00 | — | — | |
| SCHEMBL306399 | 1.00 | — | — | |
| SCHEMBL6999 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL633397 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL324663 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL633398 | 0.97 | — | — | |
| Bromide SCHEMBL10896397 | 0.97 | — | — | |
| SCHEMBL29085817 | 0.97 | — | — | |
| Ethane SCHEMBL28182655 | 0.97 | — | — |
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 1651 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117586255-A | Oral ATP competitive kinase inhibitor and synthesis method thereof | 上海图芃生物科技有限公司 | 2024-02-23 | — | — | CN | claimed |
| US-20240043435-A1 | TYK-2 INHIBITOR | BEONE MEDICINES I GMBH (CH) | 2024-02-08 | — | — | US | claimed |
| CN-111187233-B | Polysubstituted benzothiazole and derivative and synthesis method thereof | 湘潭大学 | 2023-05-30 | — | — | CN | claimed |
| CN-116102545-A | Diaryl urea PI3K/mTOR/HDAC multi-target inhibitor, and pharmaceutical composition and application thereof | 贵州医科大学 | 2023-05-12 | — | — | CN | claimed |
| US-20220127254-A1 | INDAZOLYL-ISOXAZOLE DERIVATIVES FOR THE TREATMENT OF DISEASES SUCH AS CANCER | MERCK PATENT GMBH (DE) | 2022-04-28 | — | — | US | claimed |
| CN-112209900-A | Method for preparing 4-cyclohexylmorpholine compound by using lignin model compound | 华东师范大学 | 2021-01-12 | — | — | CN | claimed |
| CN-107709319-B | Synthesis process of substituted pyridopyrimidine compounds | 中国科学院上海药物研究所 | 2020-11-06 | — | — | CN | claimed |
| CN-106008559-B | Synthesis process of substituted pyridopyrimidine compounds | 中国科学院上海药物研究所 | 2020-10-16 | — | — | CN | claimed |
| EP-3275882-B1 | PROCESS OF SYNTHESIZING SUBSTITUTED PYRIDINE AND PYRIMIDINE COMPOUND | SHANGHAI INST MATERIA MEDICA CAS (CN) | 2020-09-23 | — | — | EP | claimed |
| CN-111187233-A | Polysubstituted benzothiazole and derivative and synthesis method thereof | 湘潭大学 | 2020-05-22 | — | — | CN | claimed |
| EP-3275882-A1 | PROCESS OF SYNTHESIZING SUBSTITUTED PYRIDINE AND PYRIMIDINE COMPOUND | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2018-01-31 | — | — | EP | claimed |
| CN-104582707-B | Triazine compounds | 斯法尔制药私人有限公司 | 2017-09-26 | — | — | CN | claimed |
| CN-106008559-A | Synthesis process of substituted pyridopyrimidine compounds | 中国科学院上海药物研究所 | 2016-10-12 | — | — | CN | claimed |
| CN-105820175-A | Thiophene and pyridine compound as well as preparation method and application thereof | 四川大学 | 2016-08-03 | — | — | CN | claimed |
| CN-102939292-A | Spirocyclic compounds and their use as therapeutic agents and diagnostic probes | UNIV BASEL | 2013-02-20 | — | — | CN | claimed |
| US-20130040934-A1 | SPIROCYCLIC COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES | UNIVERSITY OF BASEL (CH) | 2013-02-14 | — | — | US | claimed |
| EP-2547684-A1 | SPIROCYCLIC COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES | University of Basel (CH) | 2013-01-23 | — | — | EP | claimed |
| WO-2011114275-A1 | SPIROCYCLIC COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS AND DIAGNOSTIC PROBES | UNIVERSITY OF BASEL (CH) | 2011-09-22 | — | — | WO | claimed |
| WO-2009102937-A1 | PROCESSES FOR THE PREPARATION OF CARBON-LINKED TETRAHYDRO-PYRAZOLO-PYRIDINE MODULATORS OF CATHEPSIN S | SUNESIS PHARMACEUTICALS, INC. (US) | 2009-08-20 | — | — | WO | claimed |
| US-20090174077-A1 | Method for Structuring a Substrate | POLARIS INNOVATIONS LIMITED (IE) | 2009-07-09 | — | — | US | claimed |