⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2943055 | 0.93 | NAAA (0.52) | — | |
| SCHEMBL11540697 | 0.91 | NAAA (0.55) | — | |
| SCHEMBL7796126 | 0.91 | NAAA (0.55) | — | |
| SCHEMBL31339496 | 0.91 | NAAA (0.55) | — | |
| SCHEMBL15344619 | 0.91 | NAAA (0.55) | — | |
| SCHEMBL1080854 | 0.91 | NAAA (0.55) | — | |
| SCHEMBL2946164 | 0.91 | NAAA (0.55) | — | |
| SCHEMBL10820639 | 0.91 | NAAA (0.55) | — | |
| SCHEMBL2943009 | 0.91 | NAAA (0.55) | — | |
| SCHEMBL2947567 | 0.91 | NAAA (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 100 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109638354-B | Lithium ion battery electrolyte and lithium ion battery | 南通新宙邦电子材料有限公司 | 2021-04-09 | — | — | CN | claimed |
| EP-3329035-B1 | PROCESS FOR PRETREATMENT OF PLASTIC SURFACES FOR METALLIZATION | BASF SE (DE) | 2019-05-22 | — | — | EP | claimed |
| US-9758476-B2 | Ortho-alkynyl anilines and process for preparation thereof | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2017-09-12 | — | — | US | claimed |
| US-20170197911-A1 | ORTHO-ALKYNYL ANILINES AND PROCESS FOR PREPARATION THEREOF | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2017-07-13 | — | — | US | claimed |
| WO-2015198343-A1 | ORTHO-ALKYNYL ANILINES AND PROCESS FOR PREPARATION THEREOF | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2015-12-30 | — | — | WO | claimed |
| EP-0772597-B1 | 3,4-SUBSTITUTED PYRAZOLES FOR THE TREATMENT OF INFLAMMATION | SEARLE & CO (US) | 2001-12-12 | — | — | EP | claimed |
| EP-0407341-B1 | Selective herbicidal agent | CIBA GEIGY AG (CH) | 1995-12-06 | — | — | EP | claimed |
| EP-0274127-B1 | Biologically degradable derivatives of poly(hydroxy alkyl)aminodicarboxylic acid, process for their preparation and their use for sustained release compositions | HOECHST AG (DE) | 1993-12-01 | — | — | EP | claimed |
| US-20250116797-A1 | METHOD FOR PREPARING ESTER THIOL COMPOUND AND OPTICAL RESIN CONTAINING THE SAME | KS OPTICAL CO., LTD. (KR) | 2025-04-10 | — | — | US | disclosed |
| CN-119390976-A | Preparation of heterogeneous photocatalyst and application of heterogeneous photocatalyst in controllable free radical polymerization | 河北大学 | 2025-02-07 | — | — | CN | disclosed |
| CN-119285565-A | Melamine monoamine ester derivative and preparation method thereof | 四川金象赛瑞化工股份有限公司 | 2025-01-10 | — | — | CN | disclosed |
| CN-118162157-A | Catalyst for synthesizing alkyl alkynoic acid or alkyl alkynoic acid ester compound and preparation method thereof | 中国石油化工股份有限公司 | 2024-06-11 | — | — | CN | disclosed |
| CN-116120287-A | Heteroaromatic carboxamide derivatives as inhibitors of plasma kallikrein | 勃林格殷格翰国际有限公司 | 2023-05-16 | — | — | CN | disclosed |
| EP-3802504-B1 | BENZOTHIA(DI)AZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS | ALBIREO AB (SE) | 2023-01-18 | — | — | EP | disclosed |
| US-4005215-A | DIURETIC | BAYER AKTIENGESELLSCHAFT (DT) | 1977-01-25 | — | — | US | disclosed |
| US-4000294-A | DIURESIS OR SALURESIS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-12-28 | — | — | US | disclosed |
| US-3992404-A | DIURETICS, SALURETICS, ANTIHYPERTENSIVE AGENTS, AND ANTITHROMBOTIC AGENTS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-11-16 | — | — | US | disclosed |
| US-3978077-A | DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC | BAYER AKTIENGESELLSCHAFT (GB) | 1976-08-31 | — | — | US | disclosed |
| US-3957814-A | DIURETICS, SALURETICS, HYPOTENSIVE AGENTS, ANTITHROMBOTIC | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-18 | — | — | US | disclosed |
| US-3952008-A | DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC | BAYER AKTIENGESELLSCHAFT (DT) | 1976-04-20 | — | — | US | disclosed |