⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4372816 | 0.97 | ALDH1A1 (0.59) | — | |
| SCHEMBL28749668 | 0.86 | TDP1 (0.50) | — | |
| SCHEMBL15234523 | 0.79 | CYP1A1 (0.51) | — | |
| SCHEMBL15234491 | 0.79 | CYP1A1 (0.51) | — | |
| Boric Acid SCHEMBL28141304 | 0.79 | ALDH1A1 (0.42) | — | |
| SCHEMBL103128 | 0.79 | — | — | |
| SCHEMBL29476041 | 0.79 | — | — | |
| SCHEMBL25212486 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL30927149 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL8181149 | 0.77 | TDP1 (0.55) | — |
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 1441 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119798252-A | Method for preparing N-ortho-acyl substituted nitrogen-containing heterocyclic compound and amine-shrinking iron (II) complex thereof | 中国石油化工股份有限公司 | 2025-04-11 | — | — | CN | claimed |
| CN-119707773-A | Preparation method and application of maleimide structure-containing compound | 中国农业大学 | 2025-03-28 | — | — | CN | claimed |
| CN-119143751-A | N-ortho-acyl substituted nitrogen-containing heterocyclic compound and preparation method of amine-shrinking iron (II) complex thereof | 中国石油化工股份有限公司 | 2024-12-17 | — | — | CN | claimed |
| CN-119144344-A | Liquid crystal compound containing 2, 5-difluorobenzene alkyne, synthesis method and liquid crystal composition | 西安近代化学研究所 | 2024-12-17 | — | — | CN | claimed |
| CN-119143750-A | Preparation method of N-ortho-alkyl substituted 1, 10-phenanthroline compound and catalyst prepared by same | 中国石油化工股份有限公司 | 2024-12-17 | — | — | CN | claimed |
| CN-118183708-A | Method for preparing fluorocarbon material by using fluorine-containing polymer | 重庆大学锂电及新材料遂宁研究院 | 2024-06-14 | — | — | CN | claimed |
| CN-117623987-A | Isothiocyanate liquid crystal compound containing 2, 5-difluoro substituted benzene and synthesis method | 西安近代化学研究所 | 2024-03-01 | — | — | CN | claimed |
| CN-114031974-A | Ink for ink jet printing and electroluminescent device | 广东聚华印刷显示技术有限公司 | 2022-02-11 | — | — | CN | claimed |
| CN-111269247-B | Preparation method of buprofezin drug molecule with escherichia coli inhibition effect | 河南科技大学第一附属医院 | 2020-11-24 | — | — | CN | claimed |
| CN-110642741-A | Functionalized benzamide derivatives as antiviral agents against HBV infection | 巴鲁克斯布隆伯格研究所 | 2020-01-03 | — | — | CN | claimed |
| US-20020068753-A1 | 2,3-oxidosqualene-lanosterol cyclase inhibitors | HOFFMANN-LA ROCHE INC. | 2002-06-06 | — | — | US | claimed |
| WO-2002042303-A2 | ACYL AND SULFONYL DERIVATIVES OF 6,9-DISUBSTITUTED 2-(TRANS-1,4-DIAMINOCYCLOHEXYL)-PURINES AND THEIR USE AS ANTIPROLIFERATIVE AGENTS | AVENTIS PHARMACEUTICALS INC. (US) | 2002-05-30 | — | — | WO | claimed |
| WO-2002020483-A1 | PIPERIDINE DERIVATIVES FOR USE 2,3-OXIDOSQUALENE-LANOSTEROL CYCLASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2002-03-14 | — | — | WO | claimed |
| WO-2002012442-A2 | HETEROCYCLIC COMPOUNDS AS LIGANDS OF THE GABAA RECEPTOR | NEUROGEN CORPORATION (US) | 2002-02-14 | — | — | WO | claimed |
| EP-0667337-B1 | Method for preparing fluoroanilines | CLARIANT GMBH (DE) | 1998-01-21 | — | — | EP | claimed |
| US-5498794-A | Process for preparing fluoroanilines | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-03-12 | — | — | US | claimed |
| EP-0667337-A1 | Method for preparing fluoroanilines | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-08-16 | — | — | EP | claimed |
| US-5354495-A | Homo- or copolymerizable through ethylenic unsaturation | NIPPON PAINT CO., LTD. (JP) | 1994-10-11 | — | — | US | claimed |
| EP-0177122-B1 | ACRYLAMIDE DERIVATIVES | Nippon Paint Co., Ltd. (JP) | 1992-04-01 | — | — | EP | claimed |
| US-4935413-A | ELASTICITY, ADHESION AND DISPERSIBILITY | NIPPON PAINT CO., LTD. (JP) | 1990-06-19 | — | — | US | claimed |