Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6354181 | 0.82 | TSHR (0.53) | TSHRLMNAALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL28344467 | 0.81 | TSHR (0.45) | TSHRLMNAALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL437240 | 0.78 | APOBEC3G (0.33) | TSHRALDH1A1CYP2A6SMN1; SMN2 | |
| SCHEMBL8525837 | 0.77 | CYP1A2 (0.36) | TSHRLMNAALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL11206197 | 0.76 | TSHR (0.45) | TSHRLMNAALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL174758 | 0.74 | TSHR (0.50) | TSHRLMNAALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL25740915 | 0.74 | ALDH1A1 (0.45) | TSHRLMNAALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL29049714 | 0.72 | TSHR (0.47) | TSHRLMNAALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL14318421 | 0.72 | TSHR (0.47) | TSHRLMNAALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL11447749 | 0.72 | TSHR (0.47) | TSHRLMNAALDH1A1CYP2A6CYP1A2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6372030-B1 | INK VEHICLE SELECTED FROM 4-(HEXADECYLAMINO)BENZYLAMINE, N-OCTANOYL-N-METHYL GLUCAMINE, OCTANOIC HYDRAZIDE, 4-HEXADECYL SULFONYL ANILINE, A CONDUCTIVE COMPLEX OF AN AMINE COMPOUND WITH A PHOSPHORUS OR SULFUR-CONTAINING ACID | XEROX CORPORATION | 2002-04-16 | — | — | US | claimed |
| EP-0794936-B1 | METHOD FOR PREPARING FLUOROANILINES FROM NITROFLUOROBENZENE COMPOUNDS | RHODIA CHIMIE SA (FR) | 1999-03-17 | — | — | EP | disclosed |
| US-5856577-A | Process for the preparation of fluoroanilines from fluorinated nitrated benzene compounds | RHONE-POULENC CHIMIE (FR) | 1999-01-05 | — | — | US | disclosed |
| EP-0875497-A2 | Method for preparing fluoroanilines from nitrofluorobenzene compounds | RHODIA CHIMIE (FR) | 1998-11-04 | — | — | EP | disclosed |
| EP-0794936-A1 | METHOD FOR PREPARING FLUOROANILINES FROM NITROFLUOROBENZENE COMPOUNDS | RHONE-POULENC CHIMIE (FR) | 1997-09-17 | — | — | EP | disclosed |
| WO-1996016926-A1 | METHOD FOR PREPARING FLUOROANILINES FROM NITROFLUOROBENZENE COMPOUNDS | RHONE-POULENC CHIMIE (FR) | 1996-06-06 | — | — | WO | disclosed |