Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 8/20 | 0.38 |
| ▸ | SCD | O00767 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | IDH1 | O75874 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | IDH2 | P48735 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12436752 | 0.74 | ALDH1A1 (0.40) | NPC1RAB9AMAPTLMNAGLA | |
| SCHEMBL8149940 | 0.72 | IDH1 (0.44) | NPC1RAB9APRMT6MAPTIDH1 | |
| SCHEMBL950428 | 0.68 | NPC1 (0.43) | NPC1RAB9APRMT6MAPTIDH1 | |
| SCHEMBL16644170 | 0.68 | ALDH1A1 (0.36) | NPC1RAB9ALMNASCDNPSR1 | |
| SCHEMBL20758150 | 0.68 | CA12 (0.38) | PRMT6MAPTLMNAGLAPOLB | |
| SCHEMBL28308930 | 0.68 | NR3C2 (0.36) | MAPTLMNAGLASCN9ASCD | |
| SCHEMBL14380299 | 0.67 | PRMT6 (0.39) | NPC1RAB9APRMT6MAPTPOLB | |
| SCHEMBL5545937 | 0.67 | PRMT6 (0.42) | NPC1RAB9APRMT6MAPTPOLB | |
| SCHEMBL31587061 | 0.66 | AKR1C3 (0.37) | LMNAGLA | |
| SCHEMBL1094013 | 0.66 | NPC1 (0.63) | NPC1RAB9APRMT6MAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-108040481-A | Five-membered ring heterocycle with sulphur substitution kills harmful organism activity Polycyclic derivative | 先正达参股股份有限公司 | 2018-05-15 | — | — | CN | disclosed |
| EP-3286187-A1 | PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES | Syngenta Participations AG (CH) | 2018-02-28 | — | — | EP | disclosed |
| WO-2016169886-A1 | PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE-MEMBERED RING HETEROCYLES | SYNGENTA CROP PROTECTION AG (CH) | 2016-10-27 | — | — | WO | disclosed |