Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.33 |
| ▸ | ACP3 | P15309 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12401757 | 1.00 | CYP2A6 (0.40) | CYP2A6ALDH1A1HIF1ACYP1B1HSD17B10 | |
| SCHEMBL28771103 | 0.80 | CYP1A2 (0.41) | CYP2A6ALDH1A1CYP1B1CYP1A2KIF11 | |
| SCHEMBL26522360 | 0.78 | CYP2A6 (0.43) | CYP2A6ALDH1A1CYP1A2TSHRTDP1 | |
| Bromide SCHEMBL21461363 | 0.78 | ALDH1A1 (0.35) | CYP2A6ALDH1A1HIF1ACYP1B1HSD17B10 | |
| SCHEMBL18053304 | 0.78 | PGR (0.47) | CYP1B1CYP1A2ESR2 | |
| SCHEMBL24712674 | 0.78 | CYP1A2 (0.57) | CYP2A6ALDH1A1HIF1ACYP1B1HSD17B10 | |
| SCHEMBL26579482 | 0.78 | CYP1A2 (0.39) | CYP2A6ALDH1A1HIF1ACYP1B1HSD17B10 | |
| SCHEMBL15853141 | 0.78 | CYP1A2 (0.41) | CYP2A6ALDH1A1HIF1ACYP1B1HSD17B10 | |
| SCHEMBL17030753 | 0.76 | ALDH1A1 (0.40) | CYP2A6ALDH1A1HIF1ACYP1B1HSD17B10 | |
| SCHEMBL2454488 | 0.76 | CYP2A6 (0.40) | CYP2A6ALDH1A1HIF1ACYP1B1HSD17B10 |
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-117756598-A | Preparation method of 1- (tertiary butyl) -3-chloronaphthalene | 中钢集团南京新材料研究院有限公司 | 2024-03-26 | — | — | CN | claimed |
| CN-114736099-B | Preparation method of 1- (tertiary butyl) -3-chloronaphthalene | 江苏南大光电材料股份有限公司 | 2023-06-06 | — | — | CN | claimed |
| CN-114736099-A | Preparation method of 1- (tert-butyl) -3-chloronaphthalene | 江苏南大光电材料股份有限公司 | 2022-07-12 | — | — | CN | claimed |
| CN-118955572-A | Organic electroluminescent material and device | 环球展览公司 | 2024-11-15 | — | — | CN | disclosed |
| CN-118955570-A | Organic electroluminescent material and device | 环球展览公司 | 2024-11-15 | — | — | CN | disclosed |
| CN-118955571-A | Organic electroluminescent material and device | 环球展览公司 | 2024-11-15 | — | — | CN | disclosed |
| CN-115974903-B | Preparation method of 2- (4- (tert-butyl) naphthalene-2-yl) -4, 5-tetramethyl-1, 3, 2-dioxaborane | 中钢集团南京新材料研究院有限公司 | 2024-10-29 | — | — | CN | disclosed |
| CN-107892702-B | Organic electroluminescent material and device | 环球展览公司 | 2024-08-20 | — | — | CN | disclosed |
| CN-117756598-A | Preparation method of 1- (tertiary butyl) -3-chloronaphthalene | 中钢集团南京新材料研究院有限公司 | 2024-03-26 | — | — | CN | disclosed |
| CN-117756598-A | Preparation method of 1- (tertiary butyl) -3-chloronaphthalene | 中钢集团南京新材料研究院有限公司 | 2024-03-26 | — | — | CN | disclosed |
| CN-117756598-A | Preparation method of 1- (tertiary butyl) -3-chloronaphthalene | 中钢集团南京新材料研究院有限公司 | 2024-03-26 | — | — | CN | disclosed |
| WO-2023221165-A1 | METHOD FOR PREPARING 1-(TERT-BUTYL)-3-CHLORONAPHTHALENE | 江苏南大光电材料股份有限公司 | 2023-11-23 | — | — | WO | disclosed |
| CN-116969984-A | Preparation method of 2- (4- (tert-butyl) naphthalene-2-yl) -4, 5-tetramethyl-1, 3, 2-dioxaborane | 郑州药领医药科技有限公司 | 2023-10-31 | — | — | CN | disclosed |
| CN-114736099-B | Preparation method of 1- (tertiary butyl) -3-chloronaphthalene | 江苏南大光电材料股份有限公司 | 2023-06-06 | — | — | CN | disclosed |
| CN-114736099-B | Preparation method of 1- (tertiary butyl) -3-chloronaphthalene | 江苏南大光电材料股份有限公司 | 2023-06-06 | — | — | CN | disclosed |
| CN-114736099-B | Preparation method of 1- (tertiary butyl) -3-chloronaphthalene | 江苏南大光电材料股份有限公司 | 2023-06-06 | — | — | CN | disclosed |
| CN-115974903-A | Preparation method of 2- (4- (tert-butyl) naphthalene-2-yl) -4, 5-tetramethyl-1, 3, 2-dioxaborane | 中钢集团南京新材料研究院有限公司 | 2023-04-18 | — | — | CN | disclosed |
| CN-114736099-A | Preparation method of 1- (tert-butyl) -3-chloronaphthalene | 江苏南大光电材料股份有限公司 | 2022-07-12 | — | — | CN | disclosed |
| CN-114736099-A | Preparation method of 1- (tert-butyl) -3-chloronaphthalene | 江苏南大光电材料股份有限公司 | 2022-07-12 | — | — | CN | disclosed |
| CN-114736099-A | Preparation method of 1- (tert-butyl) -3-chloronaphthalene | 江苏南大光电材料股份有限公司 | 2022-07-12 | — | — | CN | disclosed |