Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 6/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.47 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.47 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.43 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14079463 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL19126196 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL28191065 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL17064993 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL38666225 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL38666622 | 1.00 | CXCR4 (0.50) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| Water SCHEMBL23198430 | 0.98 | CXCR4 (0.49) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| SCHEMBL15363110 | 0.98 | CXCR4 (0.49) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| Fluoride SCHEMBL30331126 | 0.98 | CXCR4 (0.49) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 | |
| Hydrochloric Acid SCHEMBL30330428 | 0.98 | CXCR4 (0.51) | CXCR4ALDH1A1L3MBTL1S1PR1S1PR3 |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE39033-E1 | Potentiation of the microbicide 2-(thiocyanomethylthio)benzothiazole using an N-alkyl heterocyclic compound | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 2006-03-21 | — | — | US | claimed |
| EP-0857021-B1 | POTENTIATION OF BIOCIDE ACTIVITY USING AN N-ALKYL HETEROCYCLIC COMPOUND | BUCKMAN LABOR INC (US) | 2003-08-27 | — | — | EP | claimed |
| CN-1374834-A | Microbicidal compositions and methods of using compositions of propiconazole and N-alkyl heterocyclic compounds and salts thereof | BUCKMAN LABOR INC (US) | 2002-10-16 | — | — | CN | claimed |
| EP-1206186-A1 | MICROBICIDAL COMPOSITIONS AND METHODS USING COMBINATIONS OF PROPICONAZOLE AND N-ALKYL HETEROCYCLES AND SALTS THEREOF | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 2002-05-22 | — | — | EP | claimed |
| EP-0837631-B1 | POTENTIATION OF THE MICROBICIDE 2-(THIOCYANOMETHYLTHIO)BENZOTHIAZOLE USING AN N-ALKYL HETEROCYCLIC COMPOUND | BUCKMAN LABOR INC (US) | 2001-09-05 | — | — | EP | claimed |
| WO-2001010217-A1 | MICROBICIDAL COMPOSITIONS AND METHODS USING COMBINATIONS OF PROPICONAZOLE AND N-ALKYL HETEROCYCLES AND SALTS THEREOF | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 2001-02-15 | — | — | WO | claimed |
| US-5925616-A | SYNERGISTIC MIXTURES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1999-07-20 | — | — | US | claimed |
| EP-0923375-A2 | TREATMENT OF FUNGAL INFECTIONS USING A COMBINATION OF AN ANTI-FUNGAL COMPOUND AND AN N-ALKYL HETEROCYCLIC COMPOUND | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1999-06-23 | — | — | EP | claimed |
| CN-1190869-A | Potentiation of microbicidal activity using an N-alkyl heterocyclic compound | BUCKMAN LABOR INC (US) | 1998-08-19 | — | — | CN | claimed |
| EP-0857021-A1 | POTENTIATION OF BIOCIDE ACTIVITY USING AN N-ALKYL HETEROCYCLIC COMPOUND | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1998-08-12 | — | — | EP | claimed |
| CN-1187757-A | Potentiation of microbicide 2-(thiocyanomethylthio) benzothiazole using N-alkyl heterocyclic compound | BUCKMAN LABOR INC (US) | 1998-07-15 | — | — | CN | claimed |
| EP-0837631-A1 | POTENTIATION OF THE MICROBICIDE 2-(THIOCYANOMETHYLTHIO)BENZOTHIAZOLE USING AN N-ALKYL HETEROCYCLIC COMPOUND | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1998-04-29 | — | — | EP | claimed |
| WO-1998006265-A2 | TREATMENT OF FUNGAL INFECTIONS USING A COMBINATION OF AN ANTI-FUNGAL COMPOUND AND AN N-ALKYL-HETEROCYCLIC COMPOUND, ESPECIALLY N-DODECYL-MORPHOLINE | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1998-02-19 | — | — | WO | claimed |
| US-5693631-A | SYNERGISTIC | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1997-12-02 | — | — | US | claimed |
| EP-0697813-B1 | N-DODECYL HETEROCYCLIC COMPOUNDS USEFUL AS INDUSTRIAL MICROBICIDES AND PRESERVATIVES | BUCKMAN LABOR INC (US) | 1997-09-17 | — | — | EP | claimed |
| WO-1996038042-A1 | POTENTIATION OF THE MICROBICIDE 2-(THIOCYANOMETHYLTHIO)BENZOTHIAZOLE USING AN N-ALKYL HETEROCYCLIC COMPOUND | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1996-12-05 | — | — | WO | claimed |
| WO-1996038043-A1 | POTENTIATION OF BIOCIDE ACTIVITY USING AN N-ALKYL HETEROCYCLIC COMPOUND | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1996-12-05 | — | — | WO | claimed |
| EP-0697813-A1 | N-DODECYL HETEROCYCLIC COMPOUNDS USEFUL AS INDUSTRIAL MICROBICIDES AND PRESERVATIVES | BUCKMAN LABOR INC (US) | 1996-02-28 | — | — | EP | claimed |
| WO-1994026112-A1 | N-DODECYL HETEROCYCLIC COMPOUNDS USEFUL AS INDUSTRIAL MICROBICIDES AND PRESERVATIVES | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1994-11-24 | — | — | WO | claimed |
| US-5250194-A | Slimicides, fungicides; for aqueous systems, cooling water, papermaking, paints | BUCKMAN LABORATORIES INTERNATIONAL, INC. (US) | 1993-10-05 | — | — | US | claimed |