Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 10/20 | 0.50 |
| ▸ | CES1 | P23141 | 9/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL12143976 | 0.76 | CES2 (0.54) | CES2CES1MCL1HPGDRAB9A | |
| Benzil SCHEMBL11180287 | 0.73 | CES2 (0.82) | CES2CES1HPGDRAB9ATSHR | |
| Benzil SCHEMBL15657351 | 0.71 | CES2 (0.61) | CES2CES1MCL1HPGDRAB9A | |
| SCHEMBL8038758 | 0.71 | HSD17B10 (0.43) | CES2CES1MCL1HPGDSMN1; SMN2 | |
| SCHEMBL9388111 | 0.71 | MCL1 (0.41) | CES2CES1MCL1RAB9ASMN1; SMN2 | |
| Benzil SCHEMBL66 | 0.69 | CES2 (1.00) | CES2CES1HPGDRAB9ASMN1; SMN2 | |
| Benzil SCHEMBL2156589 | 0.69 | CES2 (1.00) | CES2CES1HPGDRAB9ASMN1; SMN2 | |
| Benzil SCHEMBL7142843 | 0.69 | CES2 (1.00) | CES2CES1HPGDRAB9ASMN1; SMN2 | |
| Benzil SCHEMBL9517636 | 0.69 | CES2 (1.00) | CES2CES1HPGDRAB9ASMN1; SMN2 | |
| Benzil SCHEMBL28475956 | 0.69 | CES2 (1.00) | CES2CES1HPGDRAB9ASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5446203-A | Synthesis of haloenones and aryl or alkyl substituted enones or alkenes | NEW YORK UNIVERSITY (US) | 1995-08-29 | — | — | US | disclosed |
| EP-0656878-A4 | SYNTHESIS OF HALOENONES AND ARYL OR ALKYL SUBSTITUTED ENONES OR ALKENES. | — | 1995-07-05 | — | — | EP | disclosed |
| EP-0656878-A1 | SYNTHESIS OF HALOENONES AND ARYL OR ALKYL SUBSTITUTED ENONES OR ALKENES | NEW YORK UNIVERSITY (US) | 1995-06-14 | — | — | EP | disclosed |
| WO-1994005617-A1 | SYNTHESIS OF HALOENONES AND ARYL OR ALKYL SUBSTITUTED ENONES OR ALKENES | NEW YORK UNIVERSITY (US) | 1994-03-17 | — | — | WO | disclosed |