SCHEMBL30451388

SCHEMBL30451388

NC(=O)NCCCCS(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.46
EPHX2 P34913 2/20 0.46
LMNA P02545 1/20 0.39
SLC6A6 P31641 1/20 0.39
CYP2C19 P33261 1/20 0.39
BLM P54132 1/20 0.39
ALOX15 P16050 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.36
HIF1A Q16665 1/20 0.36
ALDH1A1 P00352 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PAOX Q6QHF9 2/20 0.34
POLB P06746 1/20 0.33
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL10002627 0.95 APP (0.46) APPEPHX2LMNASLC6A6CYP2C19
SCHEMBL8664606 0.86 LMNA (0.42) APPEPHX2LMNASLC6A6CYP2C19
SCHEMBL5842513 0.83 KDM4E (0.38) EPHX2LMNAALOX15KDM4EMAPK1
SCHEMBL1837224 0.83 KDM4E (0.48) LMNABLMKDM4EMAPK1HIF1A
Toluene SCHEMBL28888307 0.82 ALDH1A1 (0.43) LMNACYP2C19ALDH1A1MEN1KMT2A
SCHEMBL28904376 0.81 KDM4E (0.41) EPHX2KDM4EMAPK1HIF1AALDH1A1
P-Cresol SCHEMBL29047183 0.80 RAB9A (0.41) EPHX2LMNACYP2C19ALDH1A1
SCHEMBL4100132 0.80 ALOX15 (0.56) APPEPHX2LMNASLC6A6CYP2C19
SCHEMBL1839119 0.80 KDM4E (0.52) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2
SCHEMBL1309360 0.80 KDM4E (0.52) KDM4EMAPK1HIF1AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117686604-A Method for determining metabolic product 益诺思生物技术南通有限公司 2024-03-12 CN claimed
CN-121717808-B Imidazopyridine derivative and preparation method, pharmaceutical composition and application thereof Hunan Xianshi Pharmaceutical Co.,Ltd. (CN) 2026-05-26 CN disclosed
CN-122070287-A IRAK 4-targeted degradation agent compound and application thereof 江苏先声药业有限公司 2026-05-19 CN disclosed
CN-119350323-B N-sulfonyl amide nitrogen-containing fused heterocycle compounds targeting p53 mutation and application thereof 上海宇道生物技术有限公司 2025-06-13 CN disclosed
CN-120092002-A Condensed heteroaromatics, composition and application thereof 海南先声再明医药股份有限公司 2025-06-03 CN disclosed
CN-119907796-A Amide compound, composition and application thereof 海南先声再明医药股份有限公司 2025-04-29 CN disclosed
CN-119841799-A Polyphenol compound, and preparation method and application thereof 复旦大学 2025-04-18 CN disclosed
CN-115093408-B Benzylamine-containing 5, 6-heteroaromatic compounds useful against mycobacterial infections 盐野义制药株式会社 2025-03-11 CN disclosed
CN-119604500-A Heterocyclic pyrimidine compound and application thereof 海南先声再明医药股份有限公司 2025-03-11 CN disclosed
CN-113717198-B Process for preparing substituted polycyclic pyridone derivatives and crystals thereof 盐野义制药株式会社 2025-03-07 CN disclosed
CN-116656771-A Detection method for judging whether test object is SLC transporter substrate or inhibitor 江苏鼎泰药物研究(集团)股份有限公司 2023-08-29 CN disclosed
CN-113648318-B Use of enhancing cell thermogenesis and treating diseases 中国科学院上海营养与健康研究所 2023-08-25 CN disclosed
CN-113105486-B Boric acid ester compound and pharmaceutically acceptable salt thereof, and preparation method and application thereof 南京师范大学 2023-08-15 CN disclosed
CN-116589469-A 1H-pyrazole derivatives as Syk and VEGFR2 double-target inhibitors and application thereof 苏州欧康维视生物科技有限公司 2023-08-15 CN disclosed
CN-113943717-B CYP2C9 mutant, corresponding nucleic acid segment and application thereof 北京医院 2023-08-08 CN disclosed
CN-116529390-A Method for evaluating excretion of test substance by human hepatocyte-like cells JSR株式会社 2023-08-01 CN disclosed
CN-114755335-B Quantitative detection method for pyrimidine derivative 1D228 enantiomer in biological sample 广东莱恩医药研究院有限公司 2023-07-28 CN disclosed
CN-116466000-A Method for rapidly determining 176 PPCPs content in source water 福建省产品质量检验研究院(福建省缺陷产品召回技术中心) 2023-07-21 CN disclosed
CN-116410127-A Multi-target anti-schizophrenia phenylpyridine piperazine compound, and preparation method and application thereof 上海医药工业研究院有限公司 2023-07-11 CN disclosed
CN-114364679-B 1H-pyrazole derivatives as Syk and VEGFR2 double-target inhibitors and application thereof 苏州欧康维视生物科技有限公司 2023-06-09 CN disclosed