Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 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 | |
|---|---|---|---|---|
| SCHEMBL8569478 | 0.96 | ALDH1A1 (0.39) | ALDH1A1KDM4ETDP1L3MBTL1PKM | |
| SCHEMBL8569325 | 0.88 | DNM1 (0.43) | ALDH1A1KDM4ETDP1L3MBTL1PKM | |
| SCHEMBL2464746 | 0.78 | ALDH1A1 (0.47) | ALDH1A1KDM4ETDP1L3MBTL1PKM | |
| SCHEMBL18886610 | 0.78 | KDM4E (0.47) | ALDH1A1KDM4ETDP1L3MBTL1USP2 | |
| SCHEMBL7548952 | 0.77 | PKM (0.37) | ALDH1A1KDM4EL3MBTL1PKMCTDSP1 | |
| Hydrochloric Acid SCHEMBL10658965 | 0.76 | KDM4E (0.50) | ALDH1A1KDM4ETDP1L3MBTL1PKM | |
| Iodide SCHEMBL9713862 | 0.76 | CHRNA7 (0.47) | ALDH1A1KDM4ETDP1L3MBTL1PKM | |
| Bromide SCHEMBL11405069 | 0.76 | KDM4E (0.45) | ALDH1A1KDM4ETDP1USP2HPGD | |
| SCHEMBL9242506 | 0.75 | ALDH1A1 (0.44) | ALDH1A1KDM4ETDP1L3MBTL1PKM | |
| Hydrochloric Acid SCHEMBL11599165 | 0.75 | KDM4E (0.48) | ALDH1A1KDM4ETDP1USP2HPGD |
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-1037175-C | Halomethylbenzoyl cyanides and process for preparing same | BASF AG (DE) | 1998-01-28 | — | — | CN | disclosed |
| US-5705674-A | Process for preparing ortho-nitrobenzonitriles | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-01-06 | — | — | US | disclosed |
| EP-0619300-B1 | Process for the preparation of halogenmethylbenzoyl cyanides and halogenmethyl benzoylcyanides | BASF AG (DE) | 1996-12-27 | — | — | EP | disclosed |
| US-5510528-A | Preparation of halomethylbenzoly cyanides and novel halomethylbenzoyl cyanides | BASF AKTIENGESELLSCHAFT (DE) | 1996-04-23 | — | — | US | disclosed |
| US-5446199-A | Preparation of halomethylbenzoyl cyanides and novel halomethylbenzoyl cyanides | BASF AKTIENGESELLSCHAFT (DE) | 1995-08-29 | — | — | US | disclosed |
| CN-1097412-A | Preparation of halomethylbenzoyl cyanides and novel halomethylbenzoyl cyanides | BASF AG (DE) | 1995-01-18 | — | — | CN | disclosed |
| EP-0619300-A2 | Process for the preparation of halogenmethylbenzoyl cyanides and halogenmethyl benzoylcyanides | BASF Aktiengesellschaft (DE) | 1994-10-12 | — | — | EP | disclosed |