Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.53 |
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.50 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | PDE4A | P27815 | 3/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL6779941 | 0.88 | OPRD1 (0.53) | SMN1; SMN2NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL6779935 | 0.88 | OPRD1 (0.53) | SMN1; SMN2NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL11486614 | 0.87 | CES2 (0.53) | CES2CES1MTNR1AMTNR1BPARP1 | |
| SCHEMBL11486610 | 0.87 | CES2 (0.53) | CES2CES1MTNR1AMTNR1BPARP1 | |
| SCHEMBL15275783 | 0.86 | PARP1 (0.56) | CES2CES1MTNR1AMTNR1BPARP1 | |
| SCHEMBL7550000 | 0.85 | RAB9A (0.52) | CES2CES1MTNR1AMTNR1BSMN1; SMN2 | |
| SCHEMBL15280988 | 0.83 | CES2 (0.49) | CES2CES1MTNR1AMTNR1BPARP1 | |
| SCHEMBL10398950 | 0.83 | ALDH1A1 (0.50) | CES2CES1MTNR1AMTNR1BPARP1 | |
| SCHEMBL11762780 | 0.83 | CES2 (0.49) | CES2CES1MTNR1AMTNR1BPARP1 | |
| SCHEMBL10397713 | 0.83 | ALDH1A1 (0.50) | CES2CES1MTNR1AMTNR1BPARP1 |
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-6703504-B2 | HAVING SUBSTANTIAL ORIENTATIONAL RIGIDITY OF AROMATIC RINGS WITH RESPECT TO CENTRAL INDANE MOIETY AND ELECTRON DONATING FUNCTIONALITY WHICH PROMINENTLY ACTIVATES AND ACCELERATES ELECTROPHILIC AROMATIC SUBSTITUTION OF PARENT RINGS | Slemon, Clarke (CA) | 2004-03-09 | — | — | US | disclosed |
| US-20030232932-A1 | Conformationally constrained compounds as dendrimer cores | SLEMON, CLARKE (CA) | 2003-12-18 | — | — | US | disclosed |
| WO-1994025427-A1 | ETHANOLAMINE DERIVATIVES USEFUL FOR THE TREATMENT OF GASTROINTESTINAL DISORDERS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-11-10 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20030232932-A1 | Conformationally constrained compounds as dendrimer cores | PCNA, PICALM, CROCC | CES2 3669/4885CES1 4830/4885MTNR1A 2983/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.