Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.38 |
| ▸ | TNF | P01375 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6999811 | 0.83 | ATM (0.47) | ALDH1A1ALOX5MAPTRXFP1SMN1; SMN2 | |
| SCHEMBL7002378 | 0.81 | PKM (0.47) | ALDH1A1ALOX5MAPTSMN1; SMN2KDM4E | |
| SCHEMBL7001011 | 0.77 | SMYD3 (0.48) | ALDH1A1SMN1; SMN2 | |
| SCHEMBL7713400 | 0.76 | ALDH1A1 (0.44) | ALDH1A1ALOX5NPC1MAPTRXFP1 | |
| SCHEMBL6996556 | 0.70 | NPC1 (0.35) | ALDH1A1TNFNPC1MAPTSMN1; SMN2 | |
| SCHEMBL2743316 | 0.69 | NPC1 (0.57) | ALDH1A1NPC1MAPTMEN1RAB9A | |
| SCHEMBL7240961 | 0.69 | TSHR (0.48) | ALDH1A1NPC1MAPTSMN1; SMN2KDM4E | |
| SCHEMBL30420736 | 0.68 | SMN1; SMN2 (0.58) | ALDH1A1TNFNPC1MAPTSMN1; SMN2 | |
| SCHEMBL27568226 | 0.68 | NPC1 (0.51) | ALDH1A1NPC1MAPTNPSR1RAB9A | |
| SCHEMBL2743418 | 0.68 | CTNNB1 (0.54) | ALDH1A1NPC1MAPTKDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1015437-B1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AG (DE) | 2003-12-03 | — | — | EP | disclosed |
| US-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |
| EP-1015437-A1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AKTIENGESELLSCHAFT (DE) | 2000-07-05 | — | — | EP | disclosed |
| WO-1999012915-A1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-03-18 | — | — | WO | disclosed |