Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 3/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | PRKCI | P41743 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | QPCT | Q16769 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Benzimidazole SCHEMBL19876247 | 0.88 | SMN1; SMN2 (0.46) | MMP12SMN1; SMN2PARP1PDPK1CA12 | |
| Benzimidazole SCHEMBL29062446 | 0.88 | MMP12 (0.44) | MMP12SMN1; SMN2PARP1PDPK1CA12 | |
| Benzimidazole SCHEMBL29218507 | 0.87 | MMP12 (0.47) | MMP12SMN1; SMN2PARP1PDPK1CA12 | |
| Benzimidazole SCHEMBL29358377 | 0.87 | — | — | |
| Benzimidazole SCHEMBL6009 | 0.87 | — | — | |
| Benzimidazole SCHEMBL461969 | 0.87 | SMN1; SMN2 (0.50) | MMP12SMN1; SMN2PARP1PDPK1CA12 | |
| Benzimidazole SCHEMBL29408372 | 0.87 | — | — | |
| Benzimidazole SCHEMBL10931770 | 0.87 | SMN1; SMN2 (0.50) | MMP12SMN1; SMN2PARP1PDPK1CA12 | |
| Benzimidazole SCHEMBL5040740 | 0.85 | KDM4E (0.47) | MMP12SMN1; SMN2PARP1PDPK1CA12 | |
| Benzimidazole SCHEMBL376958 | 0.85 | MMP12 (0.46) | MMP12SMN1; SMN2PARP1PDPK1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109721582-A | A kind of preparation method of 1,3- oxa- cycloalkanes | 中国石油化工股份有限公司 | 2019-05-07 | — | — | CN | disclosed |
| CN-109721462-A | A method of preparing long-chain alkyl benzene | 中国石油化工股份有限公司 | 2019-05-07 | — | — | CN | disclosed |
| CN-109722282-A | A method of preparing alkylate oil | 中国石油化工股份有限公司 | 2019-05-07 | — | — | CN | disclosed |
| CN-109721584-A | A method of preparing 1,4- dioxane | 中国石油化工股份有限公司 | 2019-05-07 | — | — | CN | disclosed |