Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18415611 | 1.00 | SMN1; SMN2 (0.49) | SMN1; SMN2NPC1RAB9APOLBMAPT | |
| SCHEMBL20194474 | 1.00 | SMN1; SMN2 (0.49) | SMN1; SMN2NPC1RAB9APOLBMAPT | |
| SCHEMBL19707207 | 0.81 | RAB9A (0.47) | SMN1; SMN2NPC1RAB9AEPHX1PTGS1 | |
| SCHEMBL23030353 | 0.81 | SMN1; SMN2 (0.54) | SMN1; SMN2NPC1RAB9APOLBMAPT | |
| SCHEMBL23004981 | 0.81 | SMN1; SMN2 (0.54) | SMN1; SMN2NPC1RAB9APOLBMAPT | |
| 2-(Phenylamino)Cyclohexanol SCHEMBL432131 | 0.81 | ALDH1A1 (0.51) | SMN1; SMN2RAB9APOLBMAPTEPHX1 | |
| 2-(Phenylamino)Cyclohexanol SCHEMBL432132 | 0.81 | ALDH1A1 (0.51) | SMN1; SMN2RAB9APOLBMAPTEPHX1 | |
| 2-(Phenylamino)Cyclohexanol SCHEMBL432135 | 0.81 | ALDH1A1 (0.51) | SMN1; SMN2RAB9APOLBMAPTEPHX1 | |
| 2-(Phenylamino)Cyclohexanol SCHEMBL432136 | 0.81 | ALDH1A1 (0.51) | SMN1; SMN2RAB9APOLBMAPTEPHX1 | |
| 2-(Phenylamino)Cyclohexanol SCHEMBL432133 | 0.81 | ALDH1A1 (0.51) | SMN1; SMN2RAB9APOLBMAPTEPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109735582-B | Method for synthesizing cyclohexanol beta-amino alcohol derivatives on line by lipase catalysis | 浙江工业大学 | 2022-06-21 | — | — | CN | disclosed |
| CN-109735582-A | A kind of method of lipase-catalyzed online synthesizing cyclohexane 1 alcohols beta-alkamine derivative | 浙江工业大学 | 2019-05-10 | — | — | CN | disclosed |
| EP-1150963-A1 | SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | Aventis Pharma Deutschland GmbH (DE) | 2001-11-07 | — | — | EP | disclosed |
| WO-2000046214-A1 | SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2000-08-10 | — | — | WO | disclosed |