Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.44 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8952221 | 1.00 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL5691457 | 0.80 | PAX8 (0.39) | ALDH1A1TSHRKMT2AMEN1HTT | |
| SCHEMBL16701743 | 0.78 | TDP1 (0.44) | SMN1; SMN2ALDH1A1TSHRTDP1KMT2A | |
| SCHEMBL31481084 | 0.77 | ALDH1A1 (0.49) | SMN1; SMN2ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL8799963 | 0.76 | CYP1A2 (0.39) | SMN1; SMN2ALDH1A1TSHRTDP1RAB9A | |
| SCHEMBL8799973 | 0.76 | CYP1A2 (0.39) | SMN1; SMN2ALDH1A1TSHRTDP1RAB9A | |
| SCHEMBL12680494 | 0.75 | ALDH1A1 (0.51) | SMN1; SMN2ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL9189302 | 0.75 | KMT2A (0.44) | SMN1; SMN2ALDH1A1KMT2AMEN1GAA | |
| SCHEMBL8616788 | 0.74 | ALDH1A1 (0.51) | SMN1; SMN2ALDH1A1CYP3A4TSHRTDP1 | |
| SCHEMBL12312174 | 0.73 | MAPT (0.57) | SMN1; SMN2ALDH1A1CYP3A4TSHRTDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0641764-B1 | Process for the preparation of hydroxyalkylaminonitrobenzene derivatives | CLARIANT GMBH (DE) | 1998-05-20 | — | — | EP | disclosed |
| US-5508467-A | REACTING AN AMINE SUBSTITUTED BENZONITRILE WITH AN ACYLCHLORIDE IN APROTIC SOLVENT; REARRANGEMENT IN PRESENCE OF ABASE | CASSELLA AKTIENGESELLSCHAFT (DE) | 1996-04-16 | — | — | US | disclosed |
| EP-0641764-A2 | Process for the preparation of hydroxyalkylaminonitrobenzene derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-03-08 | — | — | EP | disclosed |