Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN2 | P17706 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ICAM1 | P05362 | 3/20 | 0.30 |
| ▸ | SELE | P16581 | 3/20 | 0.30 |
| ▸ | NR4A2 | P43354 | 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 | |
|---|---|---|---|---|
| SCHEMBL4217287 | 0.89 | PTPN2 (0.38) | PTPN2PTPN1PTPN6APPTSHR | |
| SCHEMBL9342607 | 0.83 | IDO1 (0.45) | APPTDP1L3MBTL1 | |
| SCHEMBL16639668 | 0.81 | MAOB (0.37) | PTPN2PTPN1PTPN6APPTSHR | |
| SCHEMBL10618295 | 0.79 | IDO1 (0.50) | L3MBTL1 | |
| SCHEMBL16125550 | 0.79 | TSHR (0.34) | PTPN2PTPN1PTPN6APPTSHR | |
| SCHEMBL9875918 | 0.78 | IDO1 (0.44) | PTPN2PTPN1PTPN6APPTDP1 | |
| SCHEMBL18994253 | 0.77 | AGXT (0.40) | APP | |
| SCHEMBL28444172 | 0.77 | TSHR (0.54) | TSHRTDP1L3MBTL1NR4A2 | |
| SCHEMBL9343529 | 0.76 | PTPN2 (0.42) | PTPN2PTPN1PTPN6TDP1NR4A2 | |
| Hydrogen Peroxide SCHEMBL9342834 | 0.76 | IDO1 (0.47) | L3MBTL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5877312-A | Method for preparing alkylating agents for their use for alkylating cyclic ureas | DUPONT PHARMACEUTICALS COMPANY (US) | 1999-03-02 | — | — | US | disclosed |
| US-5637780-A | Method for preparing alkylating agents and their use for alkylating cyclic ureas | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-06-10 | — | — | US | disclosed |
| EP-0767770-A1 | METHOD FOR PREPARING ALKYLATING AGENTS AND THEIR USE FOR ALKYLATING CYCLIC UREAS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-04-16 | — | — | EP | disclosed |
| WO-1996000708-A1 | METHOD FOR PREPARING ALKYLATING AGENTS AND THEIR USE FOR ALKYLATING CYCLIC UREAS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-01-11 | — | — | WO | disclosed |