Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 11/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 5/20 | 0.41 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.36 |
| ▸ | GGPS1 | O95749 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16641940 | 0.83 | ARG1 (0.31) | — | |
| SCHEMBL89041 | 0.83 | FDPS (0.48) | FDPSSMPD1GGPS1 | |
| SCHEMBL2868221 | 0.80 | SMPD1 (0.50) | FDPSSMPD1GGPS1 | |
| SCHEMBL640735 | 0.80 | SMPD1 (0.50) | FDPSSMPD1GGPS1 | |
| SCHEMBL2865214 | 0.80 | SMPD1 (0.50) | FDPSSMPD1GGPS1 | |
| SCHEMBL346990 | 0.80 | FDPS (0.46) | FDPSSMPD1GGPS1 | |
| SCHEMBL8403723 | 0.80 | SMPD1 (0.50) | FDPSSMPD1GGPS1 | |
| SCHEMBL242456 | 0.80 | SMPD1 (0.50) | FDPSSMPD1GGPS1 | |
| SCHEMBL868284 | 0.80 | SMPD1 (0.50) | FDPSSMPD1GGPS1 | |
| SCHEMBL7648793 | 0.80 | SMPD1 (0.50) | FDPSSMPD1GGPS1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5705674-A | Process for preparing ortho-nitrobenzonitriles | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-01-06 | — | — | US | disclosed |