Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.55 |
| ▸ | CES1 | P23141 | 2/20 | 0.55 |
| ▸ | PARP1 | P09874 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | CTNNB1 | P35222 | 4/20 | 0.47 |
| ▸ | WNT3A | P56704 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL15252567 | 0.85 | CTNNB1 (0.50) | CES2CES1PARP1MEN1KMT2A | |
| SCHEMBL4869301 | 0.82 | CA12 (0.50) | CES2CES1PARP1KDM4ETSHR | |
| SCHEMBL11756446 | 0.82 | TP53 (0.56) | KDM4EMAPTNPC1RAB9AFBP1 | |
| SCHEMBL28415551 | 0.81 | CES2 (0.66) | CES2CES1MEN1KMT2AKDM4E | |
| SCHEMBL1277041 | 0.81 | PARP1 (0.50) | PARP1MEN1KMT2AKDM4EMAPT | |
| SCHEMBL339923 | 0.81 | ERCC5 (0.58) | PARP1KMT2ASMN1; SMN2 | |
| SCHEMBL8980284 | 0.81 | PBRM1 (0.49) | CES2CES1MEN1KMT2AKDM4E | |
| SCHEMBL5619554 | 0.81 | PARP1 (0.50) | PARP1MEN1KMT2AMAPTHPGD | |
| SCHEMBL6782133 | 0.79 | NPC1 (0.53) | CES2CES1MEN1KMT2AMAPT | |
| SCHEMBL8779987 | 0.79 | ERCC5 (0.61) | MEN1KMT2AMAPTHTTNPC1 |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110746307-B | Preparation method of 1-nitro-2-ethyl-4-fluorobenzene | 韶远科技（上海)有限公司 | 2021-07-06 | — | — | CN | claimed |
| WO-2021082752-A1 | PREPARATION METHOD FOR 1-NITRO-2-ETHYL-4-FLUOROBENZENE | 韶远科技（上海)有限公司 | 2021-05-06 | — | — | WO | claimed |
| CN-110746307-A | Preparation method of 1-nitro-2-ethyl-4-fluorobenzene | 韶远科技（上海)有限公司 | 2020-02-04 | — | — | CN | claimed |
| CN-105327703-A | Preparation method for gold nanometer catalyst, and obtained catalyst product and application thereof | USTC UNIV SCIENCE TECH CN | 2016-02-17 | — | — | CN | claimed |
| CN-117550981-B | Preparation method of 2-amino-5-fluoro acetophenone | 成都工业学院 | 2024-03-15 | — | — | CN | disclosed |
| CN-117550981-A | Preparation method of 2-amino-5-fluoro acetophenone | 成都工业学院 | 2024-02-13 | — | — | CN | disclosed |
| CN-110746307-B | Preparation method of 1-nitro-2-ethyl-4-fluorobenzene | 韶远科技（上海)有限公司 | 2021-07-06 | — | — | CN | disclosed |
| CN-110746307-B | Preparation method of 1-nitro-2-ethyl-4-fluorobenzene | 韶远科技（上海)有限公司 | 2021-07-06 | — | — | CN | disclosed |
| WO-2021082752-A1 | PREPARATION METHOD FOR 1-NITRO-2-ETHYL-4-FLUOROBENZENE | 韶远科技（上海)有限公司 | 2021-05-06 | — | — | WO | disclosed |
| WO-2021082752-A1 | PREPARATION METHOD FOR 1-NITRO-2-ETHYL-4-FLUOROBENZENE | 韶远科技（上海)有限公司 | 2021-05-06 | — | — | WO | disclosed |
| CN-110746307-A | Preparation method of 1-nitro-2-ethyl-4-fluorobenzene | 韶远科技（上海)有限公司 | 2020-02-04 | — | — | CN | disclosed |
| CN-110746307-A | Preparation method of 1-nitro-2-ethyl-4-fluorobenzene | 韶远科技（上海)有限公司 | 2020-02-04 | — | — | CN | disclosed |
| CN-105327703-A | Preparation method for gold nanometer catalyst, and obtained catalyst product and application thereof | USTC UNIV SCIENCE TECH CN | 2016-02-17 | — | — | CN | disclosed |
| EP-0442655-B1 | Benzisoxazole derivatives | ZENECA LTD (GB) | 1996-01-17 | — | — | EP | disclosed |
| US-5176737-A | BENZISOXAZOLE COMPOUNDS USEFUL AS HERBICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-01-05 | — | — | US | disclosed |
| CN-1054064-A | Heterogeneous ring compound | ICI PLC (GB) | 1991-08-28 | — | — | CN | disclosed |
| EP-0442655-A2 | Benzisoxazole derivatives | ZENECA LIMITED (GB) | 1991-08-21 | — | — | EP | disclosed |
| US-4528025-A | Herbicidally active quinoline or quinoxaline acetophenone oxime derivatives | PPG INDUSTRIES, INC. (US) | 1985-07-09 | — | — | US | disclosed |
| US-4456466-A | Herbicidally active benzoxazolyl acetophenone oxime derivatives | PPG INDUSTRIES, INC. (US) | 1984-06-26 | — | — | US | disclosed |
| US-4440930-A | Herbicidally active quinoline or quinoxaline acetophenone oxime derivatives | PPG INDUSTRIES, INC. (US) | 1984-04-03 | — | — | US | disclosed |