Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.63 |
| ▸ | RAB9A | P51151 | 3/20 | 0.63 |
| ▸ | HDAC4 | P56524 | 12/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 11/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.48 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21223292 | 0.87 | NPC1 (0.63) | NPC1RAB9AHDAC4HDAC6HDAC8 | |
| SCHEMBL29975230 | 0.84 | HDAC4 (0.55) | NPC1RAB9AHDAC4HDAC6HDAC8 | |
| SCHEMBL19357146 | 0.83 | HDAC6 (0.53) | NPC1RAB9AHDAC4HDAC6HDAC8 | |
| SCHEMBL29677980 | 0.81 | HDAC6 (0.47) | NPC1RAB9AHDAC4HDAC6HDAC8 | |
| SCHEMBL30826517 | 0.79 | HDAC6 (0.47) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL27897967 | 0.78 | CASP3 (0.62) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL30102095 | 0.78 | NPC1 (1.00) | NPC1RAB9AHDAC6KDM4EALDH1A1 | |
| SCHEMBL1281643 | 0.77 | NPC1 (0.64) | NPC1RAB9AKDM4EUSP2ALDH1A1 | |
| SCHEMBL26969155 | 0.77 | HDAC4 (0.48) | HDAC4HDAC6HDAC8HDAC1HDAC5 | |
| SCHEMBL18205159 | 0.76 | HDAC4 (0.52) | HDAC4HDAC6HDAC8 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112004813-B | Oxadiazole compounds for controlling phytopathogenic fungi | PI工业有限公司 | 2024-03-29 | — | — | CN | disclosed |
| CN-113788800-B | Preparation method and application of 5-trifluoromethyl substituted oxadiazole compound containing diphenyl ether group | 南京林业大学 | 2023-09-26 | — | — | CN | disclosed |
| CN-103764635-A | Novel trifluoromethyl-oxadiazole derivatives and their use in the treatment of disease | NOVARTIS AG | 2014-04-30 | — | — | CN | disclosed |
| WO-2011088181-A9 | COMPOUNDS AND METHODS | TEMPERO PHARMACEUTICALS, INC. (US) | 2013-01-31 | — | — | WO | disclosed |
| WO-2013006408-A1 | COMPOUNDS AND METHODS | TEMPERO PHARMACEUTICALS, INC. (US) | 2013-01-10 | — | — | WO | disclosed |
| EP-2533783-A1 | COMPOUNDS AND METHODS | Tempero Pharmaceuticals, Inc. (US) | 2012-12-19 | — | — | EP | disclosed |
| WO-2011088181-A1 | COMPOUNDS AND METHODS | TEMPERO PHARMACEUTICALS, INC. (US) | 2011-07-21 | — | — | WO | disclosed |