⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21876485 | 0.79 | GAA (0.47) | — | |
| SCHEMBL5144816 | 0.78 | TSHR (0.35) | — | |
| Hydrochloric Acid SCHEMBL17023393 | 0.77 | GAA (0.46) | — | |
| SCHEMBL396120 | 0.77 | CXCL8 (0.55) | — | |
| SCHEMBL30912304 | 0.77 | RAB9A (0.54) | — | |
| SCHEMBL29793294 | 0.77 | CXCL8 (0.55) | — | |
| SCHEMBL29706541 | 0.74 | — | — | |
| SCHEMBL6703503 | 0.74 | — | — | |
| SCHEMBL693155 | 0.72 | — | — | |
| SCHEMBL17073475 | 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 291 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110088102-A | A kind of nitrogen-containing hetero cyclics, preparation method, pharmaceutical composition and application | 罗欣药业(上海)有限公司 | 2019-08-02 | — | — | CN | claimed |
| CN-109762026-A | A kind of fluorine-containing phenanthrenequione skeleton asymmetry alpha-diimine nickel (II) complex and preparation method and application | 常州大学 | 2019-05-17 | — | — | CN | claimed |
| CN-109535008-A | A kind of synthetic method of 5-trifluoromethylaniline | 耿丹风 | 2019-03-29 | — | — | CN | claimed |
| CN-106317026-B | A kind of compound being able to suppress ErbB/HDAC and preparation method thereof includes its pharmaceutical composition and application thereof | 清华大学深圳研究生院 | 2019-03-22 | — | — | CN | claimed |
| CN-109053818-A | The preparation of fluorinated alpha-diimine nickel (II) complex replaced containing ortho position benzhydryl for vinyl polymerization | 常州大学 | 2018-12-21 | — | — | CN | claimed |
| CN-107382742-A | A kind of new synthetic method of fluorine 4 (trifluoromethyl) anilinechloride of 5 chlorine of fragrance intermediate containing trifluoromethyl 2 | 梁江丽 | 2017-11-24 | — | — | CN | claimed |
| CN-107188823-A | A kind of synthetic method of the fluorine phenylhydrazine of 4 chlorine 2 | 重庆锦杉科技有限公司 | 2017-09-22 | — | — | CN | claimed |
| CN-105646233-B | The preparation technology of the fluoroaniline of 2 chlorine 6 | 连云港威远精细化工有限公司 | 2017-07-14 | — | — | CN | claimed |
| CN-104829414-B | Synthesis method of 1-bromo-2-chloro-3-fluoro-4-iodobenzene | 大连奇凯医药科技有限公司 | 2017-01-18 | — | — | CN | claimed |
| CN-105646233-A | Preparation process of 2-chloro-6-fluoroaniline | 连云港威远精细化工有限公司 | 2016-06-08 | — | — | CN | claimed |
| CN-102471288-B | Stereoselective Synthesis of Bicyclic Heterocyclic Compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2014-10-22 | — | — | CN | claimed |
| CN-102558243-B | Preparation method of alkyl-substituted 1,10-phenanthroline complex and application of complex prepared thereby as catalyst | SINOPEC CORP. (CN) | 2014-10-22 | — | — | CN | claimed |
| CN-103896921-A | Compounds and compositions as protein kinase inhibitors | NOVARTIS AG | 2014-07-02 | — | — | CN | claimed |
| CN-103857672-A | Process for the preparation of 1- (4- (4- (3, 4-dichloro-2-fluoroanilino) -7-methoxyquinazolin-6-yloxy) piperidin-1-yl) -prop-2-en-1-one hydrochloride and intermediates used therein | HANMI SCIENCE CO LTD | 2014-06-11 | — | — | CN | claimed |
| CN-103804428-A | Preparation method and application of complex | CHINA PETROLEUM & CHEMICAL | 2014-05-21 | — | — | CN | claimed |
| CN-102725283-B | Compounds and compositions as protein kinase inhibitors | IRM LLC | 2014-02-26 | — | — | CN | claimed |
| CN-103608336-A | 9- [4- (3-chloro-2-fluoro-phenylamino) -7-methoxy-quinazolin-6-yloxy ] -1, 4-diaza-spiro [5.5] undecan-5-one dimaleate, its use as a medicament and a process for its preparation | BOEHRINGER INGELHEIM INT | 2014-02-26 | — | — | CN | claimed |
| CN-103533961-A | Combined method for treating cancer by targeting epidermal growth factor receptor | BOEHRINGER INGELHEIM INT | 2014-01-22 | — | — | CN | claimed |
| CN-103237801-A | Quinoline or quinazoline derivatives having apoptosis-inducing activity on cells | HANMI HOLDINGS CO LTD | 2013-08-07 | — | — | CN | claimed |
| CN-1237963-A | Quinoline derivatives inhibiting the action of growth factors such as VEGF | ZENECA LTD (GB) | 1999-12-08 | — | — | CN | claimed |