Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 12/20 | 0.53 |
| ▸ | SPHK2 | Q9NRA0 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4825135 | 0.98 | SPHK1 (0.51) | SPHK1SPHK2 | |
| SCHEMBL4323763 | 0.91 | SPHK1 (0.61) | SPHK1SPHK2 | |
| SCHEMBL27651439 | 0.88 | SPHK1 (0.44) | SPHK1SPHK2 | |
| Bicarbonate SCHEMBL10618148 | 0.87 | SPHK1 (0.46) | SPHK1 | |
| SCHEMBL8455254 | 0.87 | SPHK1 (0.43) | SPHK1ALDH1A1 | |
| SCHEMBL11165604 | 0.86 | SPHK1 (0.61) | SPHK1SPHK2 | |
| SCHEMBL11336354 | 0.86 | SPHK1 (0.71) | SPHK1SPHK2ALDH1A1 | |
| SCHEMBL11066946 | 0.86 | SPHK1 (0.56) | SPHK1SPHK2 | |
| SCHEMBL10895877 | 0.86 | SPHK1 (0.56) | SPHK1SPHK2 | |
| SCHEMBL5678879 | 0.85 | SPHK1 (0.69) | SPHK1SPHK2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6624236-B1 | Sol-gel-condensable cyclosiloxane(meth) acrylates; dentistry | 3M ESPE AG (DE) | 2003-09-23 | — | — | US | disclosed |
| EP-1141094-A1 | CYCLOSILOXANE-BASED CROSS-LINKABLE MONOMERS, PRODUCTION THEREOF AND USE THEREOF IN POLYMERISABLE MATERIALS | 3M Espe AG (DE) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000042092-A1 | CYCLOSILOXANE-BASED CROSS-LINKABLE MONOMERS, PRODUCTION THEREOF AND USE THEREOF IN POLYMERISABLE MATERIALS | 3M ESPE AG (DE) | 2000-07-20 | — | — | WO | disclosed |