Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.38 |
| ▸ | WNT3A | P56704 | 2/20 | 0.38 |
| ▸ | PDE2A | O00408 | 7/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | OGA | O60502 | 2/20 | 0.35 |
| ▸ | GPR3 | P46089 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6336282 | 0.85 | GPR55 (0.43) | GPR55CTNNB1WNT3APDE2ANOTUM | |
| SCHEMBL8744935 | 0.82 | TSHR (0.31) | — | |
| SCHEMBL879006 | 0.80 | GPR55 (0.45) | GPR55CTNNB1WNT3APDE2ANOTUM | |
| SCHEMBL15265914 | 0.80 | CTNNB1 (0.41) | GPR55CTNNB1WNT3APDE2ANOTUM | |
| SCHEMBL26923716 | 0.77 | PDE2A (0.44) | GPR55CTNNB1WNT3APDE2AOGA | |
| SCHEMBL26938923 | 0.77 | PDE2A (0.44) | GPR55CTNNB1WNT3APDE2AOGA | |
| SCHEMBL26923489 | 0.77 | GPR55 (0.43) | GPR55CTNNB1WNT3APDE2ANOTUM | |
| SCHEMBL3669583 | 0.77 | GPR55 (0.43) | GPR55CTNNB1WNT3APDE2ANOTUM | |
| SCHEMBL15943248 | 0.77 | PDE2A (0.44) | GPR55CTNNB1WNT3APDE2AOGA | |
| SCHEMBL10202755 | 0.76 | PDE2A (0.44) | GPR55CTNNB1WNT3APDE2ANOTUM |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0537517-B1 | Method for the preparation of 2,2-difluorobenzo(1,3)dioxolecarbaldehydes and intermediates | BAYER AG (DE) | 1997-01-22 | — | — | EP | disclosed |
| US-5525739-A | Process for the preparation of 2,2-difluorobenzo[1,3]-dioxole-carbaldehydes and new intermediate products | BAYER AKTIENGESELLSCHAFT (DE) | 1996-06-11 | — | — | US | disclosed |
| US-5420308-A | 2,2-difluorobenzo (1,3)-dioxole-carbaldehydes and new intermediate products | BAYER AKTIENGESELLSCHAFT (DE) | 1995-05-30 | — | — | US | disclosed |
| EP-0537517-A1 | Method for the preparation of 2,2-difluorobenzo(1,3)dioxolecarbaldehydes and intermediates | BAYER AG (DE) | 1993-04-21 | — | — | EP | disclosed |