Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.65 |
| ▸ | RAB9A | P51151 | 4/20 | 0.65 |
| ▸ | HPGD | P15428 | 4/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.65 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.58 |
| ▸ | TNKS | O95271 | 6/20 | 0.53 |
| ▸ | PARP1 | P09874 | 3/20 | 0.53 |
| ▸ | TNKS2 | Q9H2K2 | 3/20 | 0.53 |
| ▸ | GABRP | O00591 | 2/20 | 0.53 |
| ▸ | GABRD | O14764 | 2/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.53 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.53 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.53 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.53 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.53 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL3814673 | 0.83 | NPC1 (0.63) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| SCHEMBL11497113 | 0.83 | NPC1 (0.68) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| SCHEMBL2465240 | 0.79 | HPGD (1.00) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| SCHEMBL435366 | 0.79 | HPGD (1.00) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| Methane SCHEMBL11545753 | 0.79 | SMN1; SMN2 (0.58) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| SCHEMBL9754570 | 0.78 | CYP2A6 (0.55) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| SCHEMBL16472965 | 0.77 | MAOB (0.54) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| SCHEMBL8193938 | 0.77 | GABRP (0.57) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| SCHEMBL7534251 | 0.77 | MAPT (0.55) | NPC1SMN1; SMN2RAB9AHPGDKDM4E | |
| SCHEMBL24241713 | 0.76 | KDM4E (0.63) | NPC1SMN1; SMN2RAB9AHPGDKDM4E |
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 97 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109053731-B | P-chloro-substituted pyridazinone-structure-containing spiro [ indolizine-pyrazoline ] derivative and preparation method and application thereof | 绍兴文理学院元培学院 | 2020-07-07 | — | — | CN | claimed |
| CN-109180676-B | 3,4, 5-trimethoxy substituted pyridazinone structure-containing spiro [ indolizine-pyrazoline ] derivative and preparation method thereof | 绍兴文理学院元培学院 | 2020-07-07 | — | — | CN | claimed |
| CN-109232570-B | Pyridazinone structure-containing spiro [ indolizine-pyrazoline ] derivative and preparation method and application thereof | 绍兴文理学院元培学院 | 2020-07-07 | — | — | CN | claimed |
| CN-109232572-B | P-methyl-substituted pyridazinone-structure-containing spiro [ indolizine-pyrazoline ] derivative and preparation method and application thereof | 绍兴文理学院元培学院 | 2020-06-23 | — | — | CN | claimed |
| CN-109053732-B | Para-fluorine substituted pyridazinone structure-containing spiro [ indolizine-pyrazoline ] derivative and preparation method and application thereof | 绍兴文理学院元培学院 | 2020-06-23 | — | — | CN | claimed |
| CN-109180675-B | P-methoxy substituted pyridazinone structure-containing spiro [ indolizine-pyrazoline ] derivative and preparation method and application thereof | 绍兴文理学院元培学院 | 2020-06-23 | — | — | CN | claimed |
| CN-109232571-B | P-methylmercapto-substituted pyridazinone structure-containing spiro [ indolizine-pyrazoline ] derivative and preparation method and application thereof | 绍兴文理学院元培学院 | 2020-06-23 | — | — | CN | claimed |
| CN-107602578-B | A kind of preparation method and applications of the D-Val ring substituent norcantharidin derivative of the structure containing pyridazinone | 绍兴文理学院 | 2019-07-16 | — | — | CN | claimed |
| CN-107759611-B | A kind of preparation method and applications of the L-phenylalanine ring substituent norcantharidin derivative of the structure containing pyridazinone | 绍兴文理学院 | 2019-07-16 | — | — | CN | claimed |
| CN-107722029-B | A kind of preparation method and applications of the D-Leu ring substituent norcantharidin derivative of the structure containing pyridazinone | 绍兴文理学院 | 2019-07-16 | — | — | CN | claimed |
| CN-109053731-A | A kind of pair of chlorine replaces spiral shell [indolizine-pyrazoline] derivative and the preparation method and application thereof of the structure containing pyridazinone | 绍兴文理学院元培学院 | 2018-12-21 | — | — | CN | claimed |
| CN-109053732-A | A kind of pair of fluorine replaces spiral shell [indolizine-pyrazoline] derivative and the preparation method and application thereof of the structure containing pyridazinone | 绍兴文理学院元培学院 | 2018-12-21 | — | — | CN | claimed |
| CN-107759611-A | A kind of preparation method and applications of the L phenylalanine ring substituent norcantharidin derivatives of the structure containing pyridazinone | 绍兴文理学院 | 2018-03-06 | — | — | CN | claimed |
| CN-107722029-A | A kind of preparation method and applications of the D leucine ring substituent norcantharidin derivatives of the structure containing pyridazinone | 绍兴文理学院 | 2018-02-23 | — | — | CN | claimed |
| CN-107674083-A | A kind of preparation method and applications of the L leucine ring substituent norcantharidin derivatives of the structure containing pyridazinone | 绍兴文理学院 | 2018-02-09 | — | — | CN | claimed |
| CN-107674082-A | A kind of preparation method and applications of the D phenylalanine ring substituent norcantharidin derivatives of the structure containing pyridazinone | 绍兴文理学院 | 2018-02-09 | — | — | CN | claimed |
| CN-107602578-A | A kind of preparation method and applications of the D valine ring substituent norcantharidin derivatives of the structure containing pyridazinone | 绍兴文理学院 | 2018-01-19 | — | — | CN | claimed |
| CN-106316999-A | Preparing method and application for coumarone- 2,3- diketone oxime derivative | 江苏强盛功能化学股份有限公司 | 2017-01-11 | — | — | CN | claimed |
| EP-0983507-A1 | TRICYCLIC TETRAHYDROQUINOLINE DERIVATIVES AND TRICYCLIC TETRAHYDROQUINOLINE COMBINATORIAL LIBRARIES | Trega Biosciences, Inc. (US) | 2000-03-08 | — | — | EP | claimed |
| WO-1998034111-A1 | TRICYCLIC TETRAHYDROQUINOLINE DERIVATIVES AND TRICYCLIC TETRAHYDROQUINOLINE COMBINATORIAL LIBRARIES | TREGA BIOSCIENCES, INC. (US) | 1998-08-06 | — | — | WO | claimed |