Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 4/20 | 0.41 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29978402 | 0.93 | NPC1 (0.47) | NPC1RAB9AKMT2ASMN1; SMN2MAPT | |
| SCHEMBL29978321 | 0.93 | MEN1 (0.47) | NPC1RAB9AKMT2ASMN1; SMN2MAPT | |
| SCHEMBL29978389 | 0.93 | NAMPT (0.46) | MAPTNPSR1NAMPTHDAC6HDAC4 | |
| SCHEMBL29978109 | 0.92 | RAB9A (0.46) | NPC1RAB9ASMN1; SMN2MAPTNAMPT | |
| SCHEMBL29978205 | 0.92 | HDAC4 (0.47) | NPC1RAB9AKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL29978312 | 0.92 | HDAC6 (0.39) | NPC1RAB9AKMT2ASMN1; SMN2MAPT | |
| SCHEMBL29978228 | 0.91 | CYP3A4 (0.44) | NPC1RAB9AKMT2ASMN1; SMN2MAPT | |
| SCHEMBL29978900 | 0.90 | NPC1 (0.48) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL29977870 | 0.89 | TAS1R3 (0.45) | NPC1RAB9AKMT2ASMN1; SMN2MAPT | |
| SCHEMBL29977881 | 0.88 | MAPT (0.39) | NPC1RAB9AKMT2AMAPTMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022234470-A1 | NOVEL FUSED HETEROCYCLIC COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI | PI INDUSTRIES LTD. (IN) | 2022-11-10 | — | — | WO | claimed |
| WO-2022234470-A1 | NOVEL FUSED HETEROCYCLIC COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI | PI INDUSTRIES LTD. (IN) | 2022-11-10 | — | — | WO | disclosed |