⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27449670 | 1.00 | — | — | |
| SCHEMBL28049277 | 1.00 | — | — | |
| Trimethylammonium SCHEMBL15544741 | 0.73 | — | — | |
| SCHEMBL10395750 | 0.70 | — | — | |
| SCHEMBL22282 | 0.70 | — | — | |
| Formaldehyde SCHEMBL27952790 | 0.70 | — | — | |
| Trimethylammonium SCHEMBL7521772 | 0.70 | — | — | |
| SCHEMBL244295 | 0.67 | — | — | |
| SCHEMBL438330 | 0.67 | — | — | |
| SCHEMBL26981421 | 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 377 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114761410-A | Pyrrolopyrimidinone compounds and application thereof | 广州必贝特医药股份有限公司 | 2022-07-15 | — | — | CN | claimed |
| CN-104955826-A | SPIRO-QUINAZOLINONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISEASES AND CONDITIONS | MERCK PATENT GMBH | 2015-09-30 | — | — | CN | claimed |
| CN-102858742-B | Trpv1 vanilloid receptor antagonists with a bicyclic portion | PHARMESTE SRL | 2015-05-27 | — | — | CN | claimed |
| CN-104341395-A | Novel azole compounds, process for their preparation and pharmaceutical compositions containing them | SERVIER LAB | 2015-02-11 | — | — | CN | claimed |
| CN-103351305-B | 4-(2-dimethylaminoethoxy)benzylamine preparation method | ZHEJIANG GENEBEST PHARMACEUTICAL CO., LTD. (CN) | 2014-10-08 | — | — | CN | claimed |
| CN-104011020-A | Use Of Photocleavable Compounds | FEMTONICS KFT | 2014-08-27 | — | — | CN | claimed |
| CN-102105437-B | Adamantyl diamide derivatives and uses of same | LUNDBECK & CO AS H | 2014-07-23 | — | — | CN | claimed |
| CN-103724269-A | Phenyl 1, 2-isoxazole or phenyl 1, 2-pyrazole compound and application thereof | SHANGHAI INST MATERIA MEDICA | 2014-04-16 | — | — | CN | claimed |
| CN-102099352-B | STAT3 inhibitor containing quinolinecarboxamide derivative as active ingredient | PHARMA IP GENERAL INC ASS | 2014-02-26 | — | — | CN | claimed |
| CN-103502249-A | Azaindole derivatives as tyrosine kinase inhibitors | PRINCIPIA BIOPHARMA INC | 2014-01-08 | — | — | CN | claimed |
| CN-1281444-A | Azulene hydroxamic acid derivatives as metalloprotein inhibitors | ROTSCHIDEIGNOSTIKS AG (DE) | 2001-01-24 | — | — | CN | claimed |
| CN-1259129-A | Desoxycyclodepsipeptides and their use for combatting endoparasites | BAYER AG (DE) | 2000-07-05 | — | — | CN | claimed |
| CN-1230196-A | Modified aminoacids, pharmaceuticals containing these compounds and method for their prodn. | THOMAE GMBH DR K (DE) | 1999-09-29 | — | — | CN | claimed |
| CN-1177963-A | 6-arylpyrazolo [3, 4-d ] pyrimidin-4-ones and compositions and methods of use thereof | SANOFI WINTHROP INC (US) | 1998-04-01 | — | — | CN | claimed |
| CN-1142815-A | Preparation method of E-1- [4'- (2-dimethylaminoethoxy) -phenyl ] -1- (3' -hydroxyphenyl) -2-phenyl-1-butene | KLINGE CO CHEM PHARM FAB (DE) | 1997-02-12 | — | — | CN | claimed |
| CN-1033509-C | Novel method for preparing camptothecin derivative | SMITHKLINE BEECHAM CORP (US) | 1996-12-11 | — | — | CN | claimed |
| CN-1070906-A | Aminopropane that replaces and its production and use | HOECHST AG (DE) | 1993-04-14 | — | — | CN | claimed |
| CN-1051367-A | The lactone polymerization of yttrium and catalysis of rare-earth compound | DU PONT (US) | 1991-05-15 | — | — | CN | claimed |
| CN-1049352-A | The alcohol derivate of using the 19-norsteroid prepares the method for new organic acid acetic and salt thereof | ROUSSEL UCLAF (FR) | 1991-02-20 | — | — | CN | claimed |
| CN-85101280-A | Benzene oxygen propanol amine compounds | — | 1987-01-17 | — | — | CN | claimed |