SCHEMBL29415547

SCHEMBL29415547

Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 3/20 1.00
▸ ALDH1A1 P00352 4/20 0.58
▸ HSD17B10 Q99714 4/20 0.58
▸ CASP6 P55212 3/20 0.56
▸ CYP2C9 P11712 2/20 0.56
▸ CYP2C19 P33261 2/20 0.56
▸ NSD2 O96028 3/20 0.53
▸ DUSP3 P51452 1/20 0.53
▸ PTPN5 P54829 1/20 0.53
▸ PTPN11 Q06124 1/20 0.53
▸ PTPN1 P18031 2/20 0.50
▸ CYP1A2 P05177 2/20 0.49
▸ PRMT1 Q99873 2/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ GAA P10253 2/20 0.46
▸ PLCG1 P19174 1/20 0.46
▸ DNMT1 P26358 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ MEN1 O00255 1/20 0.43

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL6840785 1.00 NT5E (1.00) NT5EALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL150291 1.00 NT5E (1.00) NT5EALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL564762 1.00 NT5E (1.00) NT5EALDH1A1HSD17B10CASP6CYP2C9
Water SCHEMBL31546582 0.98 NT5E (0.96) NT5EALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL5637025 0.98 NT5E (0.96) NT5EALDH1A1HSD17B10CASP6CYP2C9
Hydroxyl Radical SCHEMBL28160622 0.98 NT5E (0.96) NT5EALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL4870331 0.98 NT5E (0.96) NT5EALDH1A1HSD17B10CASP6CYP2C9
Water SCHEMBL12275537 0.96 NT5E (0.93) NT5EALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL10535991 0.90 NT5E (0.81) NT5EALDH1A1HSD17B10CASP6CYP2C9
SCHEMBL564761 0.90 NT5E (0.81) NT5EALDH1A1HSD17B10CASP6CYP2C9

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 46 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119799030-A Polyazo dyes or their complexes, process for their preparation and their use 广东省科学院测试分析研究所(中国广州分析测试中心) 2025-04-11 — — CN claimed
CN-119686117-A Wool fabric treatment process capable of washing and easy to color 比音勒芬服饰股份有限公司 2025-03-25 — — CN claimed
CN-119240769-A Naphthaiic disulfonic acid and/or derivative acid radical intercalation hydrotalcite-like compound, and preparation method and application thereof 中国科学院青海盐湖研究所 2025-01-03 — — CN claimed
CN-115385905-B PH color-changing reactive dye capable of dyeing cotton fabric and preparation method thereof 南通大学 2024-02-06 — — CN claimed
CN-114404323-B Permanent or semi-permanent macromolecular hair dye 浙江材华科技有限公司 2023-11-10 — — CN claimed
CN-115386244-B Double-color-body pH color-changing reactive dye and preparation and application thereof 南通大学 2023-10-20 — — CN claimed
CN-115368753-B PH color-changing reactive dye for sweat detection and preparation method thereof 南通大学 2023-08-15 — — CN claimed
CN-115385905-A PH color-changing reactive dye capable of dyeing cotton fabrics and preparation method thereof 南通大学 2022-11-25 — — CN claimed
CN-115386244-A Double-chromophore pH color-changing reactive dye and preparation and application thereof 南通大学 2022-11-25 — — CN claimed
CN-115368753-A PH color-changing reactive dye for sweat detection and preparation method thereof 南通大学 2022-11-22 — — CN claimed
CN-114404323-A Permanent or semi-permanent macromolecular hair dye 浙江材华科技有限公司 2022-04-29 — — CN claimed
CN-121471730-A Preparation method and application of disazo structure-based color-changing dye 上海工程技术大学 2026-02-06 — — CN disclosed
CN-121231402-A Method for measuring concentration of trace elements in fertilizer production process 鲁天化农业科技发展(临沂)有限公司 2025-12-30 — — CN disclosed
CN-119799030-A Polyazo dyes or their complexes, process for their preparation and their use 广东省科学院测试分析研究所(中国广州分析测试中心) 2025-04-11 — — CN disclosed
CN-119686117-A Wool fabric treatment process capable of washing and easy to color 比音勒芬服饰股份有限公司 2025-03-25 — — CN disclosed
EP-4004122-A1 FIBRE REACTIVE DYES, THEIR PREPARATION AND THEIR USE Huntsman Advanced Materials (Switzerland) GmbH (CH) 2022-06-01 — — EP disclosed
CN-114502668-A Thermally curable two-component coating composition 巴斯夫欧洲公司 2022-05-13 — — CN disclosed
CN-114404323-A Permanent or semi-permanent macromolecular hair dye 浙江材华科技有限公司 2022-04-29 — — CN disclosed
CN-114144480-A Fibre-reactive dyes, their preparation and their use 亨斯迈先进材料(瑞士)有限公司 2022-03-04 — — CN disclosed
CN-109828108-B Preparation method of artificial antibody for caffeine detection 合肥学院 2022-02-18 — — CN disclosed
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