Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.52 |
| ▸ | PTPRC | P08575 | 2/20 | 0.51 |
| ▸ | BCHE | P06276 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.51 |
| ▸ | CES1 | P23141 | 1/20 | 0.51 |
| ▸ | S100A4 | P26447 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.51 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.50 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL27408458 | 0.98 | ALDH1A1 (0.61) | ALDH1A1TDP1POLBRAB9APTGS2 | |
| Formaldehyde SCHEMBL29219144 | 0.96 | ALDH1A1 (0.59) | ALDH1A1TDP1POLBRAB9APTGS2 | |
| SCHEMBL11351696 | 0.91 | ALDH1A1 (0.58) | ALDH1A1TDP1POLBRAB9APTGS2 | |
| SCHEMBL9798213 | 0.89 | PTGS2 (0.55) | ALDH1A1TDP1POLBRAB9APTGS2 | |
| SCHEMBL10937400 | 0.87 | MAPT (0.56) | ALDH1A1TDP1POLBRAB9APTGS2 | |
| SCHEMBL10904251 | 0.85 | ALDH1A1 (0.63) | ALDH1A1TDP1POLBRAB9APTGS2 | |
| SCHEMBL6391559 | 0.85 | PTGS2 (0.69) | ALDH1A1TDP1POLBRAB9APTGS2 | |
| SCHEMBL28207049 | 0.85 | PTGS2 (0.73) | ALDH1A1TDP1POLBRAB9APTGS2 | |
| SCHEMBL5958796 | 0.84 | TDP1 (0.65) | ALDH1A1TDP1SMN1; SMN2MAPK1HIF1A | |
| SCHEMBL3276362 | 0.83 | TDP1 (0.66) | ALDH1A1TDP1POLBRAB9APTGS2 |
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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110713454-A | Nitro-substituted indole compound and preparation method thereof | 南京工业大学 | 2020-01-21 | — | — | CN | claimed |
| CN-109721497-A | The new synthetic method of one kind 2,4- dinitro biphenyl | 于鹏 | 2019-05-07 | — | — | CN | claimed |
| US-20050075324-A1 | Melanin concentrating hormone antagonists | THE PROCTER & GAMBLE COMPANY (US) | 2005-04-07 | — | — | US | claimed |
| EP-1015402-B1 | Method for producing compounds containing fluorine, in particular fluorobenzaldehydes and fluorobenzonitriles | CLARIANT GMBH (DE) | 2002-12-04 | — | — | EP | claimed |
| US-6166242-A | Method for producing compounds containing fluorine, in particular fluorobenzaldhydes and fluorobenzonitriles | AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO KG (DE) | 2000-12-26 | — | — | US | claimed |
| EP-1015402-A1 | METHOD FOR PRODUCING COMPOUNDS CONTAINING FLUORINE, IN PARTICULAR FLUOROBENZALDHYDES AND FLUOROBENZONITRILES | Aventis Research & Technologies GmbH & Co. KG (DE) | 2000-07-05 | — | — | EP | claimed |
| WO-1999011588-A1 | METHOD FOR PRODUCING COMPOUNDS CONTAINING FLUORINE, IN PARTICULAR FLUOROBENZALDHYDES AND FLUOROBENZONITRILES | AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) | 1999-03-11 | — | — | WO | claimed |
| US-4170708-A | FROM AN AROMATIC NITRO COMPOUND, AN ALCOHOL, AND CARBON MONOXIDE | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1979-10-09 | — | — | US | claimed |
| CN-110713454-B | Nitro-substituted indole compound and preparation method thereof | 南京工业大学 | 2022-12-09 | — | — | CN | disclosed |
| CN-108484372-B | Method for preparing biaryl from aryl hydrazine and brominated aromatic hydrocarbon | 绍兴文理学院 | 2021-07-02 | — | — | CN | disclosed |
| CN-110713454-A | Nitro-substituted indole compound and preparation method thereof | 南京工业大学 | 2020-01-21 | — | — | CN | disclosed |
| CN-109721497-A | The new synthetic method of one kind 2,4- dinitro biphenyl | 于鹏 | 2019-05-07 | — | — | CN | disclosed |
| CN-109721497-A | The new synthetic method of one kind 2,4- dinitro biphenyl | 于鹏 | 2019-05-07 | — | — | CN | disclosed |
| CN-109721497-A | The new synthetic method of one kind 2,4- dinitro biphenyl | 于鹏 | 2019-05-07 | — | — | CN | disclosed |
| EP-0000563-A1 | Process for preparing aromatic urethanes | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1979-02-07 | — | — | EP | disclosed |
| US-4134880-A | Process for producing an aromatic urethane from nitro compounds, hydroxyl compounds and carbon monoxide using metal-Lewis acid-ammonia catalyst systems | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1979-01-16 | — | — | US | disclosed |
| US-4080365-A | Process for preparing aromatic urethanes | MITSUI TOATSU CHEMICALS (JA) | 1978-03-21 | — | — | US | disclosed |
| US-4070391-A | Process for producing isocyanate from nitro compounds and carbon monoxide using rhodium oxide catalysts | ETHYL CORPORATION (US) | 1978-01-24 | — | — | US | disclosed |
| US-4052420-A | PROCESS FOR PRODUCING DIURETHANE FROM DINITRO COMPOUNDS, HYDROXYL COMPOUNDS AND CARBON MONOXIDE | ETHYL CORPORATION (US) | 1977-10-04 | — | — | US | disclosed |
| US-4052437-A | PROCESS FOR PRODUCING URETHANE FROM NITRO COMPOUNDS, HYDROXYL COMPOUNDS AND CARBON MONOXIDE USING RHODIUM OXIDE CATALYSTS | ETHYL CORPORATION (US) | 1977-10-04 | — | — | US | 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 (1 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-20050075324-A1 | Melanin concentrating hormone antagonists | MCHR1, MCHR2, MC1R | ALDH1A1 3383/4885TDP1 4156/4885POLB 4762/4885 |
“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.