Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30585186 | 1.00 | CES2 (0.43) | CES2MEN1KMT2AMAPTGAA | |
| SCHEMBL28539185 | 1.00 | CES2 (0.43) | CES2MEN1KMT2AMAPTGAA | |
| SCHEMBL27386587 | 0.98 | CES2 (0.45) | CES2MEN1KMT2AMAPTGAA | |
| SCHEMBL5888916 | 0.95 | MAPK1 (0.42) | CES2MEN1KMT2AMAPTGAA | |
| SCHEMBL5888917 | 0.95 | MAPK1 (0.42) | CES2MEN1KMT2AMAPTGAA | |
| SCHEMBL1680067 | 0.89 | CYP2C9 (0.45) | MEN1KMT2AMAPTCYP2C9MAPK1 | |
| SCHEMBL1119886 | 0.89 | CYP2C9 (0.45) | MEN1KMT2AMAPTCYP2C9MAPK1 | |
| SCHEMBL8453060 | 0.87 | CYP2C9 (0.44) | MEN1KMT2AMAPTCYP2C9MAPK1 | |
| SCHEMBL27711443 | 0.85 | CES2 (0.45) | CES2MEN1KMT2AMAPTGAA | |
| SCHEMBL7215220 | 0.84 | CYP2C9 (0.42) | MEN1KMT2AMAPTCYP2C9MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112961030-A | Method for catalytic synthesis of 4- (trans-4-alkylcyclohexyl) cyclohexanone | 惠泽化学科技(濮阳)有限公司 | 2021-06-15 | — | — | CN | disclosed |
| EP-2303988-A1 | LIQUID CRYSTAL COMPOSITIONS COMPRISING MESOGEN CONTAINING COMPOUNDS | TRANSITIONS OPTICAL, INC. (US) | 2011-04-06 | — | — | EP | disclosed |
| WO-2009158488-A1 | LIQUID CRYSTAL COMPOSITIONS COMPRISING MESOGEN CONTAINING COMPOUNDS | TRANSITIONS OPTICAL, INC. (US) | 2009-12-30 | — | — | WO | disclosed |