Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 5/20 | 0.39 |
| ▸ | MMP9 | P14780 | 5/20 | 0.39 |
| ▸ | MMP3 | P08254 | 4/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10458416 | 0.82 | MMP13 (0.41) | MMP13ALDH1A1TSHRCA12CA1 | |
| SCHEMBL10460203 | 0.78 | MAPT (0.42) | ALDH1A1TSHRCA12CA1CA9 | |
| SCHEMBL9375632 | 0.77 | GSTP1 (0.44) | MMP13ALDH1A1CA12CA1CA9 | |
| SCHEMBL11113445 | 0.75 | ALDH1A1 (0.49) | ALDH1A1CA12CA1CA9CA2 | |
| SCHEMBL9383630 | 0.75 | MMP13 (0.39) | MMP13ALDH1A1TSHRMAPTPOLB | |
| SCHEMBL9676170 | 0.75 | ALDH1A1 (0.48) | MMP13ALDH1A1TSHRMAPTPOLB | |
| SCHEMBL10569169 | 0.75 | SMN1; SMN2 (0.40) | ALDH1A1TSHRCA12CA1CA9 | |
| SCHEMBL10466906 | 0.72 | ALDH1A1 (0.45) | MMP13ALDH1A1TSHRMAPTMMP2 | |
| SCHEMBL9874462 | 0.72 | MMP13 (0.50) | MMP13ALDH1A1POLBMMP2MMP9 | |
| SCHEMBL9734487 | 0.72 | ALDH1A1 (0.50) | MMP13ALDH1A1POLBMMP2MMP9 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4847388-A | Polycyclic unsaturated ethers and esters | SHELL OIL COMPANY (US) | 1989-07-11 | — | — | US | claimed |
| EP-0384518-B1 | Alkenylphenol derivatives | SHELL INT RESEARCH (NL) | 1994-08-24 | — | — | EP | disclosed |
| EP-0359341-B1 | 1,6-diazaspiro[4,4]nonane-2,7-dione derivatives | SHELL INT RESEARCH (NL) | 1994-02-16 | — | — | EP | disclosed |
| US-5013805-A | Cured resin products | SHELL OIL COMPANY (US) | 1991-05-07 | — | — | US | disclosed |
| US-4968811-A | Alkenylphenol derivatives | SHELL OIL COMPANY (US) | 1990-11-06 | — | — | US | disclosed |
| EP-0384518-A1 | Alkenylphenol derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1990-08-29 | — | — | EP | disclosed |
| US-4927908-A | Curable resin composition comprising cyanato aryl spirodilactam | SHELL OIL COMPANY (US) | 1990-05-22 | — | — | US | disclosed |
| EP-0359341-A2 | 1,6-diazaspiro[4,4]nonane-2,7-dione derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1990-03-21 | — | — | EP | disclosed |
| US-4886863-A | Novel alkenylphenol derivatives | SHELL OIL COMPANY (US) | 1989-12-12 | — | — | US | disclosed |
| US-4847388-A | Polycyclic unsaturated ethers and esters | SHELL OIL COMPANY (US) | 1989-07-11 | — | — | US | disclosed |