Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 6/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 2/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6994304 | 0.83 | PDE2A (0.32) | PDE2A | |
| SCHEMBL7000031 | 0.82 | SMYD3 (0.38) | SMYD3PARP1KDRPDE3BPDE3A | |
| SCHEMBL7000098 | 0.78 | PARP1 (0.48) | SMYD3PARP1HSD17B10FAAH | |
| SCHEMBL7713374 | 0.74 | PARP1 (0.50) | PARP1HSD17B10 | |
| SCHEMBL7711431 | 0.74 | PARP1 (0.37) | SMYD3PARP1HSD17B10KDRPDE3B | |
| SCHEMBL6998255 | 0.72 | PARP1 (0.45) | SMYD3L3MBTL1PARP1KDRPDE3B | |
| SCHEMBL6302681 | 0.72 | MAPT (0.40) | SMYD3PARP1GAA | |
| SCHEMBL7713294 | 0.72 | PARP1 (0.42) | SMYD3PARP1USP2GAA | |
| SCHEMBL7708086 | 0.72 | CTSS (0.43) | SMYD3PARP1 | |
| SCHEMBL7708055 | 0.72 | PARP1 (0.41) | SMYD3PARP1HSD17B10KDRHTR1A |
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 3 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 |
| 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 |