Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | TP53 | P04637 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 8/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10465973 | 0.96 | ALDH1A1 (0.52) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL9874441 | 0.89 | ALDH1A1 (0.52) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL9676170 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL10466906 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL9374273 | 0.78 | ALDH1A1 (0.62) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL10464140 | 0.76 | ALDH1A1 (0.48) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL9879768 | 0.75 | ALDH1A1 (0.40) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL12289601 | 0.74 | ALDH1A1 (1.00) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL31537008 | 0.74 | ALDH1A1 (1.00) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 | |
| SCHEMBL37802 | 0.74 | ALDH1A1 (1.00) | ALDH1A1TP53TSHRHIF1ASMN1; SMN2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4895942-A | Novel epoxy compounds | SHELL OIL COMPANY (US) | 1990-01-23 | — | — | US | claimed |
| EP-0336475-B1 | 1,6-DIAZASPIRO (4,4)NONANE-2,7-DIONE DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1992-12-23 | — | — | EP | disclosed |
| US-5001213-A | Thermosetting resin compositions | SHELL OIL COMPANY (US) | 1991-03-19 | — | — | US | disclosed |
| US-4933423-A | Thermosetting resin compositions | SHELL OIL COMPANY (US) | 1990-06-12 | — | — | US | disclosed |
| US-4895942-A | Novel epoxy compounds | SHELL OIL COMPANY (US) | 1990-01-23 | — | — | US | disclosed |
| US-4888408-A | Polymeric polyhydroxy polyether containing 1,6-diazaspiro-[4.4]nonane-2,7-dione units | SHELL OIL COMPANY (US) | 1989-12-19 | — | — | US | disclosed |
| EP-0336475-A1 | 1,6-diazaspiro (4,4)nonane-2,7-dione derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1989-10-11 | — | — | EP | disclosed |