Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL70056 | 0.82 | CA2 (0.41) | CA2ALDH1A1POLBSMN1; SMN2 | |
| SCHEMBL2325979 | 0.72 | — | — | |
| SCHEMBL4104149 | 0.72 | — | — | |
| SCHEMBL486188 | 0.72 | — | — | |
| SCHEMBL27560428 | 0.72 | — | — | |
| Water SCHEMBL10721774 | 0.69 | CA2 (0.33) | CA2ALDH1A1 | |
| Fluoride SCHEMBL2325988 | 0.69 | CA2 (0.33) | CA2ALDH1A1 | |
| SCHEMBL5612953 | 0.69 | — | — | |
| SCHEMBL6390604 | 0.69 | — | — | |
| SCHEMBL411234 | 0.69 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112110804-B | Preparation method of 3, 5-dihalo trifluoro acetophenone and its derivative | 台州臻挚生物科技有限公司 | 2023-01-17 | — | — | CN | disclosed |
| CN-115558088-A | Piperidine tertiary amine group polymer based on carbon-based skeleton space entanglement structure and application thereof | 西湖大学 | 2023-01-03 | — | — | CN | disclosed |
| CN-111040137-B | Anion exchange polymer and preparation method and application thereof | 惠州市亿纬新能源研究院 | 2022-09-13 | — | — | CN | disclosed |
| CN-113651710-A | Preparation method of 3, 5-substituted-4-amino trifluoro acetophenone and its derivative | 杭州臻挚生物科技有限公司 | 2021-11-16 | — | — | CN | disclosed |
| CN-112778328-A | N-heterocyclic carbene catalytic functionalized imine as novel 1, 4-dipole synthon and synthetic application thereof | 南京工业大学 | 2021-05-11 | — | — | CN | disclosed |
| CN-110041235-B | N-phenyl-N-p-toluenesulfonyl trifluoroacetamide and application thereof | 大连理工大学 | 2021-04-20 | — | — | CN | disclosed |
| CN-110041235-B | N-phenyl-N-p-toluenesulfonyl trifluoroacetamide and application thereof | 大连理工大学 | 2021-04-20 | — | — | CN | disclosed |
| CN-112110804-A | Preparation method of 3, 5-dihalo-trifluoro-acetophenone and derivatives thereof | 台州臻挚生物科技有限公司 | 2020-12-22 | — | — | CN | disclosed |
| EP-3127903-B1 | 2,2'-TANDEM DITHIAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF | SHANGHAI INST MATERIA MEDICA CAS (CN) | 2017-08-23 | — | — | EP | disclosed |
| US-9643941-B2 | 2,2′-tandem dithiazole compound, preparation method therefor, and use thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2017-05-09 | — | — | US | disclosed |
| US-20170044119-A1 | 2,2'-TANDEM DITHIAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2017-02-16 | — | — | US | disclosed |
| EP-3127903-A1 | 2,2'-TANDEM DITHIAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2017-02-08 | — | — | EP | disclosed |
| US-20160368876-A1 | METHOD FOR PREPARATION OF 6-TRIFLUOROMETHYLPYRIDINE-3-CARBOXYLIC ACID DERIVATIVES FROM TRIFLUOROACETYLACETIC ACID | LONZA LTD. (CH) | 2016-12-22 | — | — | US | disclosed |
| US-9522885-B1 | Method for preparation of 6-trifluoromethylpyridine-3-carboxylic acid derivatives from trifluoroacetylacetic acid | LONZA LTD (CH) | 2016-12-20 | — | — | US | disclosed |
| CN-105492427-B | Process for preparing 6-trifluoromethylpyridine-3-carboxylic acid derivatives from trifluoroacetoacetic acid | 隆萨有限公司 | 2016-12-14 | — | — | CN | disclosed |
| EP-2997014-B1 | METHOD FOR PREPARATION OF 6-TRIFLUOROMETHYLPYRIDINE-3-CARBOXYLIC ACID DERIVATIVES FROM TRIFLUOROACETYLACETIC ACID | LONZA AG (CH) | 2016-09-21 | — | — | EP | disclosed |
| CN-105492427-A | Process for preparing 6-trifluoromethylpyridine-3-carboxylic acid derivatives from trifluoroacetoacetic acid | LONZA AG | 2016-04-13 | — | — | CN | disclosed |
| EP-2997014-A1 | METHOD FOR PREPARATION OF 6-TRIFLUOROMETHYLPYRIDINE-3-CARBOXYLIC ACID DERIVATIVES FROM TRIFLUOROACETYLACETIC ACID | Lonza Ltd (CH) | 2016-03-23 | — | — | EP | disclosed |
| WO-2015007837-A1 | METHOD FOR PREPARATION OF 6-TRIFLUOROMETHYLPYRIDINE-3-CARBOXYLIC ACID DERIVATIVES FROM TRIFLUOROACETYLACETIC ACID | LONZA LTD (CH) | 2015-01-22 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20160368876-A1 | METHOD FOR PREPARATION OF 6-TRIFLUOROMETHYLPYRIDINE-3-CARBOXYLIC ACID DERIVATIVES FROM TRIFLUOROACETYLACETIC ACID | CYP2A6, CYP2B6, HPD | CA2 164/4885ALDH1A1 308/4885POLB 3826/4885 |
| US-20170044119-A1 | 2,2'-TANDEM DITHIAZOLE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF | HDAC2, HDAC11, HDAC8 | CA2 980/4885ALDH1A1 1920/4885POLB 3256/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.