⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL186669 | 0.81 | GABRA1 (0.37) | — | |
| SCHEMBL25425763 | 0.81 | GABRA1 (0.58) | — | |
| SCHEMBL29390847 | 0.81 | GABRA1 (0.58) | — | |
| SCHEMBL36294 | 0.81 | GABRA1 (0.58) | — | |
| SCHEMBL3563147 | 0.79 | CSNK2A2 (0.44) | — | |
| SCHEMBL2186450 | 0.79 | HSPA5 (0.46) | — | |
| SCHEMBL8698489 | 0.79 | TAAR1 (0.35) | — | |
| Ammonia Solution, Strong SCHEMBL2638008 | 0.78 | GABRA1 (0.55) | — | |
| SCHEMBL14807864 | 0.78 | GABRA1 (0.55) | — | |
| SCHEMBL7542830 | 0.78 | GABRA1 (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
Appears in 2896 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4121802-B1 | HIGH REFRACTIVE INDEX SILOXANE INSERT MATERIALS FOR EMBEDDED CONTACT LENSES | ALCON INC (CH) | 2024-07-17 | — | — | EP | claimed |
| CN-117831652-A | Prediction method of olefin hydroformylation positive-to-negative ratio | 上海华谊控股集团有限公司 | 2024-04-05 | — | — | CN | claimed |
| CN-113861234-B | Complex catalyst, preparation method thereof and application thereof in preparation of polycarbonate | 源创核新(北京)新材料科技有限公司 | 2023-11-17 | — | — | CN | claimed |
| CN-116410239-A | Heteroatom-containing metallocene compound and preparation method and application thereof | 惠生(中国)投资有限公司 | 2023-07-11 | — | — | CN | claimed |
| CN-110818545-B | Method for preparing substituted aryl ketone by ketone arylation | 上海化工研究院有限公司 | 2022-12-09 | — | — | CN | claimed |
| CN-115260834-A | Sulfur-containing high-refractive-index ink composition and preparation method thereof | 西安思摩威新材料有限公司 | 2022-11-01 | — | — | CN | claimed |
| CN-110922286-B | Asymmetric aryl substituted fulvene compound and preparation method and application thereof | 上海化工研究院有限公司 | 2022-08-16 | — | — | CN | claimed |
| EP-2303331-B1 | OPHTHALMIC DEVICE HAVING THERAPEUTIC AGENT DELIVERY CAPABILITY AND METHOD OF FORMING SAME | ALCON INC (CH) | 2022-01-26 | — | — | EP | claimed |
| CN-113861234-A | Complex catalyst, preparation method thereof and application thereof in preparation of polycarbonate | 源创核新(北京)新材料科技有限公司 | 2021-12-31 | — | — | CN | claimed |
| CN-107963982-B | Polyisocyanate composition and isocyanate polymer composition | 旭化成株式会社 | 2021-11-12 | — | — | CN | claimed |
| EP-0203312-B1 | PHOSPHAZENE BASED FUNCTIONAL FLUID COMPOSITIONS | GE CHEMICALS, INC. (US) | 1990-10-31 | — | — | EP | claimed |
| US-4859569-A | Optical recording medium | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1989-08-22 | — | — | US | claimed |
| EP-0203312-A2 | Phosphazene based functional fluid compositions | GE CHEMICALS, INC. (US) | 1986-12-03 | — | — | EP | claimed |
| US-4601843-A | Phosphazene based functional fluid compositions | BORG-WARNER CHEMICALS, INC. (US) | 1986-07-22 | — | — | US | claimed |
| US-4585574-A | POSITIVE DIELECTRIC ANISOTROPY | BAYER AKTIENGESELLSCHAFT (DE) | 1986-04-29 | — | — | US | claimed |
| EP-0054217-B1 | ANTHRAQUINONE DYES, PROCESS FOR THEIR PREPARATION, THEIR USE, AS WELL AS LIQUID-CRYSTAL MATERIAL CONTAINING ANTHRAQUINONE DYES | BAYER AG (DE) | 1984-06-27 | — | — | EP | claimed |
| EP-0054217-A1 | Anthraquinone dyes, process for their preparation, their use, as well as liquid-crystal material containing anthraquinone dyes | BAYER AG (DE) | 1982-06-23 | — | — | EP | claimed |
| US-4291047-A | Combating fungi with α-azolyl-β-hydroxy-ketones | BAYER AKTIENGESELLSCHAFT (DE) | 1981-09-22 | — | — | US | claimed |
| US-3998805-A | MONOAZO DYES; POLYESTERS; YELLOW, RED, OR ORANGE SHADES | CIBA-GEIGY CORPORATION (US) | 1976-12-21 | — | — | US | claimed |
| US-3948877-A | POLYACRYLONITRILE, ACID MODIFIED POLYESTERS OR POLYAMIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-04-06 | — | — | US | claimed |