Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | P2RX4 | Q99571 | 6/20 | 0.43 |
| ▸ | P2RX1 | P51575 | 3/20 | 0.42 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8947996 | 0.84 | SMN1; SMN2 (0.75) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL8947992 | 0.84 | SMN1; SMN2 (0.71) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL11728362 | 0.83 | SMN1; SMN2 (0.82) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL9110877 | 0.82 | LMNA (0.57) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL23705539 | 0.82 | SMN1; SMN2 (1.00) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL9187854 | 0.82 | SMN1; SMN2 (0.80) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL11803865 | 0.82 | SMN1; SMN2 (0.67) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL367474 | 0.82 | SMN1; SMN2 (1.00) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL29367804 | 0.82 | SMN1; SMN2 (1.00) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 | |
| SCHEMBL338 | 0.82 | SMN1; SMN2 (1.00) | SMN1; SMN2LMNAALDH1A1MAPK1NPSR1 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5874627-A | Process for preparing polyamine derivatives and intermediates thereof | MERRELL PHARMACEUTICALS INC. (US) | 1999-02-23 | — | — | US | disclosed |
| US-5756739-A | Process for preparing polyamine derivative and intermediates thereof | MERRELL PHARMACEUTICALS INC. (US) | 1998-05-26 | — | — | US | disclosed |
| EP-0729456-B1 | NOVEL PROCESS FOR PREPARING (S)-1-[2(S)-(1,3-DIHYDRO-1,3-DIOXO-ISOINDOL-2-YL)-1-OXO-3-PHENYLPROPYL]-1,2,3,4-TETRAHYDRO-2-PYRIDINE-CARBOXYLIC ACID METHYL ESTER AND INTERMEDIATES THEREOF | MERRELL PHARMA INC (US) | 1997-12-17 | — | — | EP | disclosed |
| EP-0793967-A2 | Conjugated compounds of bile acids with thiotaurine and its N-alkyl derivatives | PRODOTTI CHIMICI E ALIMENTARI SPA (IT) | 1997-09-10 | — | — | EP | disclosed |
| EP-0729456-A1 | NOVEL PROCESS FOR PREPARING (S)-1-[2(S)-(1,3-DIHYDRO-1,3-DIOXO-ISOINDOL-2-YL)-1-OXO-3-PHENYLPROPYL]-1,2,3,4-TETRAHYDRO-2-PYRIDINE-CARBOXYLIC ACID METHYL ESTER AND INTERMEDIATES THEREOF | MERRELL PHARMACEUTICALS INC. (US) | 1996-09-04 | — | — | EP | disclosed |
| US-5508411-A | Process for preparing (S)-1-[2(S)-(1,3-dihyrdro-1,3-dioxo-isoindo-2-yl)-1-oxo-3-phenylpropyl]-1,2,3,4,-tetrahydro-2-pyridine-carboxylic acid methyl ester | MERRELL PHARMACEUTICALS INC. | 1996-04-16 | — | — | US | disclosed |
| US-5502253-A | Cyclohex-2-enyl acetamides | MERRELL PHARMACEUTICALS INC. | 1996-03-26 | — | — | US | disclosed |
| WO-1995014663-A2 | NOVEL PROCESS FOR PREPARING (S)-1-[2(S)-(1,3-DIHYDRO-1,3-DIOXO-ISOINDO-2-YL)-1-OXO-3-PHENYLPROPYL]-1,2,3,4-TETRAHYDRO-2-PYRIDINE-CARBOXYLIC ACID METHYL ESTER AND INTERMEDIATES THEREOF | MERRELL PHARMACEUTICALS INC. (US) | 1995-06-01 | — | — | WO | disclosed |
| WO-1995009832-A1 | NOVEL PROCESS FOR PREPARING POLYAMINE DERIVATIVES AND INTERMEDIATES THEREOF | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-04-13 | — | — | WO | disclosed |
| US-4045578-A | N-CHLORO-AMINO ACID DERIVATIVES EXHIBITING ANTIBACTERIAL ACTIVITY | INTERX RESEARCH CORPORATION (US) | 1977-08-30 | — | — | US | disclosed |
| US-3966796-A | ANTIBACTERIAL ACTIVITY | INTERX RESEARCH CORPORATION (US) | 1976-06-29 | — | — | US | disclosed |
| US-3960845-A | HALOGENATION | SANKYO COMPANY LIMITED (JA) | 1976-06-01 | — | — | US | disclosed |