Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | FOS | P01100 | 1/20 | 0.35 |
| ▸ | JUN | P05412 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1238436 | 0.80 | ALDH1A1 (0.40) | KMT2AALDH1A1AKR1C3CYP3A4 | |
| SCHEMBL17685853 | 0.79 | ALDH1A1 (0.52) | CYP2A6RAB9ANPC1PTGS2ALDH1A1 | |
| SCHEMBL28085114 | 0.76 | ALDH1A1 (0.52) | KMT2ACA1ALDH1A1POLBHPGD | |
| 1,3-Propanediol SCHEMBL2865031 | 0.73 | FBP1 (0.36) | KMT2AALDH1A1AKR1C3CYP3A4 | |
| SCHEMBL2863424 | 0.70 | MEN1 (0.42) | KMT2ANPC1ALDH1A1AKR1C3MAPT | |
| SCHEMBL1758330 | 0.70 | CYP2A6 (0.41) | CYP2A6RAB9AKMT2ANPC1SMN1; SMN2 | |
| SCHEMBL1758165 | 0.70 | CYP2A6 (0.41) | CYP2A6RAB9AKMT2ANPC1SMN1; SMN2 | |
| SCHEMBL4270561 | 0.70 | CYP2A6 (0.41) | CYP2A6RAB9AKMT2ANPC1SMN1; SMN2 | |
| SCHEMBL8962657 | 0.69 | GRIN2D (0.47) | CYP2A6RAB9ANPC1SMN1; SMN2CA1 | |
| SCHEMBL3338993 | 0.67 | CYP2A6 (0.48) | CYP2A6RAB9ANPC1SMN1; SMN2CA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8052961-B2 | Highly fluorinated β-amino acids and methods of making and using same | UNIVERSITY OF UTAH FOUNDATION (US) | 2011-11-08 | — | — | US | disclosed |
| US-20090259020-A1 | HIGHLY FLUORINATED BETA-AMINO ACIDS AND METHODS OF MAKING AND USING SAME | UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) | 2009-10-15 | — | — | US | 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-20090259020-A1 | HIGHLY FLUORINATED BETA-AMINO ACIDS AND METHODS OF MAKING AND USING SAME | DAO, ARRB1, ADRA2B | CYP2A6 2496/4885RAB9A 718/4885KMT2A 795/4885 |
“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.