Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.34 |
| ▸ | AGER | Q15109 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL11446729 | 0.96 | BCL2A1 (0.37) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| Ethylbenzene SCHEMBL11337300 | 0.91 | AGER (0.40) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11550114 | 0.91 | CNR2 (0.39) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11550585 | 0.89 | ALDH1A1 (0.50) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11551323 | 0.88 | CNR2 (0.38) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| Ethylbenzene SCHEMBL11570518 | 0.87 | AGER (0.38) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11446489 | 0.87 | MEN1 (0.37) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11339672 | 0.85 | MEN1 (0.34) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11465583 | 0.85 | ALDH1A1 (0.48) | NPC1MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL11332175 | 0.85 | SIGMAR1 (0.42) | NPC1MEN1KMT2AALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4156014-A | N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression | THE UPJOHN COMPANY (US) | 1979-05-22 | — | — | US | claimed |
| US-4159339-A | ANTIDEPRESSANTS | THE UPJOHN COMPANY (US) | 1979-06-26 | — | — | US | disclosed |
| US-4156014-A | N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression | THE UPJOHN COMPANY (US) | 1979-05-22 | — | — | US | disclosed |