Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 10/20 | 0.37 |
| ▸ | BCHE | P06276 | 7/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 7/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 7/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.30 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL26694311 | 1.00 | ACHE (0.37) | ACHEBCHEGRIN1GRIN2APOLB | |
| SCHEMBL24370055 | 0.71 | GRM5 (0.40) | KDM4EALDH1A1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL29569978 | 0.68 | RAB9A (0.43) | POLBKDM4EALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL26694292 | 0.68 | RAB9A (0.43) | POLBKDM4EALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL5648628 | 0.64 | PGR (0.49) | POLBKDM4EALDH1A1SMN1; SMN2GRM5 | |
| SCHEMBL28517437 | 0.64 | METAP1 (0.42) | POLBKDM4EALDH1A1 | |
| SCHEMBL31106550 | 0.64 | METAP1 (0.42) | POLBKDM4EALDH1A1 | |
| SCHEMBL16799328 | 0.61 | CA1 (0.35) | ALDH1A1GRM5 | |
| SCHEMBL30695369 | 0.61 | CYP3A4 (0.41) | POLBKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL9770689 | 0.61 | CYP3A4 (0.41) | POLBKDM4EALDH1A1MAPTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4232441-A1 | BIOACTIVE BENZOCYCLOHEPTENE ANALOGUES FROM HIMACHALENES AND ITS APPLICATIONS | Council of Scientific & Industrial Research (IN) | 2023-08-30 | — | — | EP | disclosed |
| WO-2022085023-A1 | BIOACTIVE BENZOCYCLOHEPTENE ANALOGUES FROM HIMACHALENES AND ITS APPLICATIONS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2022-04-28 | — | — | WO | disclosed |