Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | CA2 | P00918 | 4/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.62 |
| ▸ | LMNA | P02545 | 3/20 | 0.62 |
| ▸ | MAPT | P10636 | 3/20 | 0.62 |
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | HPGD | P15428 | 3/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.62 |
| ▸ | EGFR | P00533 | 2/20 | 0.62 |
| ▸ | FYN | P06241 | 2/20 | 0.62 |
| ▸ | MMP9 | P14780 | 2/20 | 0.62 |
| ▸ | RECQL | P46063 | 2/20 | 0.62 |
| ▸ | CA4 | P22748 | 2/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | CA12 | O43570 | 1/20 | 0.62 |
| ▸ | GMNN | O75496 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | CA3 | P07451 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| Catechol SCHEMBL28545800 | 0.84 | ALDH1A1 (0.67) | ALDH1A1CA2KDM4ETDP1ALOX15 | |
| Orthocresol SCHEMBL27781829 | 0.84 | TRPA1 (0.48) | ALDH1A1CA2KDM4ETDP1ALOX15 | |
| Catechol SCHEMBL27860927 | 0.83 | ALDH1A1 (0.77) | ALDH1A1CA2KDM4ETDP1ALOX15 | |
| Catechol SCHEMBL28322998 | 0.83 | ALDH1A1 (0.91) | ALDH1A1CA2KDM4ETDP1ALOX15 | |
| Catechol SCHEMBL330099 | 0.83 | — | — | |
| Catechol SCHEMBL30543687 | 0.83 | ALDH1A1 (0.91) | ALDH1A1CA2KDM4ETDP1ALOX15 | |
| Catechol SCHEMBL28144119 | 0.83 | ALDH1A1 (0.91) | ALDH1A1CA2KDM4ETDP1ALOX15 | |
| Catechol SCHEMBL28550370 | 0.79 | ALDH1A1 (0.83) | ALDH1A1CA2KDM4ETDP1ALOX15 | |
| Catechol SCHEMBL11319346 | 0.79 | ALDH1A1 (0.83) | ALDH1A1CA2KDM4ETDP1ALOX15 | |
| Catechol SCHEMBL27394877 | 0.79 | CA2 (0.83) | ALDH1A1CA2KDM4ETDP1ALOX15 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107033120-B | Preparation method of 2- (2, 2-difluorobenzo [ D ] [1,3] dioxol-5-yl) acetonitrile | 苏州旺山旺水生物医药有限公司 | 2020-03-17 | — | — | CN | claimed |
| CN-111763214-B | Preparation method of icotinib | 苏州富士莱医药股份有限公司 | 2022-03-15 | — | — | CN | disclosed |
| CN-111763214-A | Preparation method of icotinib | 苏州富士莱医药股份有限公司 | 2020-10-13 | — | — | CN | disclosed |
| CN-107033120-B | Preparation method of 2- (2, 2-difluorobenzo [ D ] [1,3] dioxol-5-yl) acetonitrile | 苏州旺山旺水生物医药有限公司 | 2020-03-17 | — | — | CN | disclosed |
| CN-107033120-A | The Preparation Method And Their Intermediate of 1- (2,2- difluoros benzo [D] [1,3] dioxole -5- bases)-cyclopropane-carboxylic acid | 苏州旺山旺水生物医药有限公司 | 2017-08-11 | — | — | CN | disclosed |
| CN-101417942-B | Method for preparing p-hydroxymandelic acid | BAOSHAN IRON & STEEL | 2011-09-21 | — | — | CN | disclosed |
| CN-101417942-A | Method for preparing p-hydroxymandelic acid | BAOSHAN IRON & STEEL (CN) | 2009-04-29 | — | — | CN | disclosed |
| EP-0380518-B1 | MELANIN CONTAINING HYDROPHILIC CONTACT LENSES | PHOTOPROTECTIVE TECHN INC (US) | 1996-07-31 | — | — | EP | disclosed |
| US-5116884-A | Melanin hydrophilic contact lenses | PHOTOPROTECTIVE TECHNOLOGY INCORPORATED (US) | 1992-05-26 | — | — | US | disclosed |
| US-5112883-A | Medium incorporating melanin as an absorbing pigment against electromagnetic radiation | PHOTOPROTECTIVE TECHNOLOGIES INCORPORATED (US) | 1992-05-12 | — | — | US | disclosed |
| EP-0380518-A4 | MELANIN HYDROPHILIC CONTACT LENSES | — | 1991-05-22 | — | — | EP | disclosed |
| EP-0380518-A1 | MELANIN HYDROPHILIC CONTACT LENSES. | PHOTOPROTECTIVE TECHN INC (US) | 1990-08-08 | — | — | EP | disclosed |
| WO-1990003954-A1 | MEDIUM INCORPORATING MELANIN AS AN ABSORBING PIGMENT FOR PROTECTION AGAINST ELECTROMAGNETIC RADIATION | PHOTOPROTECTIVE TECHNOLOGIES INCORPORATED (US) | 1990-04-19 | — | — | WO | disclosed |
| EP-0311290-A2 | Melanin hydrophilic contact lenses | PHOTOPROTECTIVE TECHNOLOGIES INC. (US) | 1989-04-12 | — | — | EP | disclosed |
| WO-1989001639-A1 | MELANIN HYDROPHILIC CONTACT LENSES | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1989-02-23 | — | — | WO | disclosed |