Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 1.00 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.66 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | LTA4H | P09960 | 1/20 | 0.59 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL1787570 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1552926 | 1.00 | ALDH1A1 (1.00) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| Methane SCHEMBL7287824 | 0.98 | ALDH1A1 (0.97) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| Hydrochloric Acid SCHEMBL5343928 | 0.98 | ALDH1A1 (0.97) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL2538632 | 0.95 | ALDH1A1 (0.90) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL24023495 | 0.91 | ALDH1A1 (0.82) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL5745229 | 0.90 | ALDH1A1 (0.81) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL608225 | 0.89 | ALDH1A1 (0.81) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL741364 | 0.89 | ALDH1A1 (0.81) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL72716 | 0.89 | ALDH1A1 (0.81) | ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19 |
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 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118459469-A | Preparation method of ibrutinib | 杭州新曦科技有限公司 | 2024-08-09 | — | — | CN | claimed |
| CN-111978242-B | Preparation method and application of (R) -3-aminopiperidine dihydrochloride | 上海科利生物医药有限公司 | 2023-09-26 | — | — | CN | claimed |
| CN-116063309-B | Synthesis method of ibrutinib | 北京京卫燕康药物研究所有限公司 | 2023-06-13 | — | — | CN | claimed |
| CN-116063309-A | Synthesis method of ibrutinib | 北京京卫燕康药物研究所有限公司 | 2023-05-05 | — | — | CN | claimed |
| CN-113640408-B | Method for analyzing piperidinol compound | 山东华素制药有限公司 | 2023-03-07 | — | — | CN | claimed |
| CN-113640408-A | Method for analyzing piperidinol compound | 山东华素制药有限公司 | 2021-11-12 | — | — | CN | claimed |
| CN-111978242-A | Preparation method and application of (R) -3-aminopiperidine dihydrochloride | 上海科利生物医药有限公司 | 2020-11-24 | — | — | CN | claimed |
| EP-3115358-B1 | METHOD OF PREPARATION AND CHIRAL INVERSION OF CHIRAL-1-T-BUTOXYCARBONYL-3-HYDROXY PIPERIDINE | ABA CHEMICALS CORP (CN) | 2019-09-11 | — | — | EP | claimed |
| EP-3170809-B1 | METHOD FOR RECYCLING CHIRAL 1-BENZYL-3-HYDROXYPIPERIDINE BY RACEMIZATION | ABA CHEMICALS CORP (CN) | 2019-04-03 | — | — | EP | claimed |
| EP-3170809-A1 | METHOD FOR RECYCLING CHIRAL 1-BENZYL-3-HYDROXYPIPERIDINE BY RACEMIZATION | ABA Chemicals Corporation (CN) | 2017-05-24 | — | — | EP | claimed |
| CN-104140390-B | The racemization recovery method of a kind of chirality 1-benzyl-3-hydroxy piperidine | 雅本化学股份有限公司 | 2016-06-08 | — | — | CN | claimed |
| CN-104140390-A | Racemization recycling method for chirality 1-benzyl-3-hydroxypiperidine | ABA CHEMICALS CORP | 2014-11-12 | — | — | CN | claimed |
| CN-118459469-A | Preparation method of ibrutinib | 杭州新曦科技有限公司 | 2024-08-09 | — | — | CN | disclosed |
| CN-117929563-A | Method for separating and measuring impurities and residual solvents in 1-benzyl-3-piperidinol | 重庆华邦制药有限公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-111978242-B | Preparation method and application of (R) -3-aminopiperidine dihydrochloride | 上海科利生物医药有限公司 | 2023-09-26 | — | — | CN | disclosed |
| CN-111978242-B | Preparation method and application of (R) -3-aminopiperidine dihydrochloride | 上海科利生物医药有限公司 | 2023-09-26 | — | — | CN | disclosed |
| WO-2002059117-A1 | PIPERAZINE- AND PIPERIDINE-DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS | ELI LILLY AND COMPANY (US) | 2002-08-01 | — | — | WO | disclosed |
| CN-1323293-A | The preparation of i(N)-substituted-hydroxycycloalkylamine derivatives | SAMSUNG FINE CHEMICALS CO LTD (KR) | 2001-11-21 | — | — | CN | disclosed |
| EP-1114027-A1 | THE PREPARATION OF N-SUBSTITUTED-HYDROXYCYCLOALKYLAMINE DERIVATIVES | Samsung Fine Chemicals Co., Ltd. (KR) | 2001-07-11 | — | — | EP | disclosed |
| WO-2000015610-A1 | THE PREPARATION OF N-SUBSTITUTED-HYDROXYCYCLOALKYLAMINE DERIVATIVES | SAMSUNG FINE CHEMICALS CO., LTD. (KR) | 2000-03-23 | — | — | WO | disclosed |