Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 6/20 | 0.59 |
| ▸ | MMP2 | P08253 | 2/20 | 0.45 |
| ▸ | MMP3 | P08254 | 2/20 | 0.45 |
| ▸ | MMP9 | P14780 | 2/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.44 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10392048 | 0.89 | MMP13 (0.50) | MMP13MMP2MMP3MMP9AKR1C3 | |
| SCHEMBL9730368 | 0.89 | MMP13 (0.63) | MMP13MMP2MMP3MMP9AKR1C3 | |
| SCHEMBL10465599 | 0.85 | MMP13 (0.47) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL9729935 | 0.84 | MMP13 (0.66) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL10401778 | 0.80 | DDB1 (0.44) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL9730839 | 0.80 | MMP13 (0.52) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL9736118 | 0.80 | CA12 (0.56) | MMP13MMP2MMP3MMP9ALDH1A1 | |
| SCHEMBL9676223 | 0.78 | MEN1 (0.44) | MMP13ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL10391857 | 0.77 | ESR1 (0.41) | MMP13ALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL9773395 | 0.76 | MMP13 (0.43) | MMP13MMP2MMP3MMP9ALDH1A1 |
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-5093499-A | Spirodilactam derivatives | SHELL OIL COMPANY (US) | 1992-03-03 | — | — | US | claimed |
| US-5093499-A | Spirodilactam derivatives | SHELL OIL COMPANY (US) | 1992-03-03 | — | — | US | disclosed |
| US-4968768-A | Polyestercarbonate polymer containing spirodi lactam moiety | SHELL OIL COMPANY (US) | 1990-11-06 | — | — | US | disclosed |