Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28059997 | 1.00 | CES2 (0.48) | CES2TAAR1NPC1RAB9AGAA | |
| SCHEMBL28060090 | 1.00 | CES2 (0.48) | CES2TAAR1NPC1RAB9AGAA | |
| SCHEMBL28171825 | 0.97 | TAAR1 (0.50) | CES2TAAR1NPC1RAB9AGAA | |
| SCHEMBL28167365 | 0.82 | CES2 (0.46) | CES2TAAR1NPC1RAB9AGAA | |
| SCHEMBL3635759 | 0.79 | NPC1 (0.53) | CES2TAAR1NPC1RAB9AGAA | |
| SCHEMBL17549492 | 0.78 | — | — | |
| SCHEMBL17533347 | 0.78 | EPHX1 (0.44) | EPHX1 | |
| SCHEMBL28361457 | 0.78 | EPHX1 (0.44) | EPHX1 | |
| SCHEMBL30714818 | 0.78 | EPHX1 (0.44) | EPHX1 | |
| SCHEMBL17533351 | 0.78 | EPHX1 (0.44) | EPHX1 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105384619-B | Isopropyl phenol derivative and preparation method thereof | 四川海思科制药有限公司 | 2020-05-29 | — | — | CN | disclosed |
| CN-106278947-B | Crystal form of phenol derivative and preparation method thereof | 四川海思科制药有限公司 | 2020-03-06 | — | — | CN | disclosed |
| CN-105384607-B | A kind of cumene amphyl and preparation method thereof | 四川海思科制药有限公司 | 2019-08-16 | — | — | CN | disclosed |
| CN-105384604-B | A kind of cumene amphyl and preparation method thereof | 四川海思科制药有限公司 | 2019-07-05 | — | — | CN | disclosed |
| CN-105820040-B | A kind of cumene amphyl and preparation method thereof | 四川海思科制药有限公司 | 2018-07-24 | — | — | CN | disclosed |
| CN-105555748-B | A kind of cumene amphyl and preparation method thereof | 四川海思科制药有限公司 | 2017-07-18 | — | — | CN | disclosed |
| CN-106278947-A | Crystal formation of phenol derivatives and preparation method thereof | 四川海思科制药有限公司 | 2017-01-04 | — | — | CN | disclosed |
| CN-105820040-A | Isopropyl-phenol derivative and preparation method thereof | 四川海思科制药有限公司 | 2016-08-03 | — | — | CN | disclosed |
| CN-105555748-A | Isopropyl phenol derivative and preparation method thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-05-04 | — | — | CN | disclosed |
| CN-105384607-A | Isopropyl-phenol derivative and preparation method therefor | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-03-09 | — | — | CN | disclosed |
| CN-105384619-A | Isopropyl-phenol derivative and preparation method therefor | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-03-09 | — | — | CN | disclosed |
| CN-105384604-A | Isopropyl-phenol derivative and preparation method therefor | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-03-09 | — | — | CN | disclosed |