SCHEMBL2194683

SCHEMBL2194683

CC(C)(C)OC(=O)N(CCCCCC(=O)O)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
TSHR P16473 5/20 0.43
LMNA P02545 2/20 0.43
NFKB1 P19838 1/20 0.43
PMP22 Q01453 1/20 0.43
ALDH1A1 P00352 3/20 0.41
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 7/20 0.41
PPARD Q03181 7/20 0.41
PPARA Q07869 7/20 0.41
HDAC11 Q96DB2 5/20 0.41
PTPN1 P18031 3/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
MEN1 O00255 1/20 0.41

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
Hydrochloric Acid SCHEMBL28881887 0.98 HDAC1 (0.45) HDAC1HDAC2HDAC6TSHRLMNA
SCHEMBL4888113 0.98 HDAC1 (0.44) HDAC1HDAC2HDAC6TSHRLMNA
SCHEMBL18281227 0.93 HDAC6 (0.41) HDAC1HDAC2HDAC6TSHRLMNA
SCHEMBL137000 0.89 HDAC6 (0.46) HDAC1HDAC2HDAC6TDP1CA14
SCHEMBL16713413 0.86 CA14 (0.53) HDAC1HDAC2HDAC6TSHRLMNA
SCHEMBL2579658 0.86 CA14 (0.53) HDAC1HDAC2HDAC6TSHRLMNA
SCHEMBL1626498 0.85 HDAC6 (0.40) HDAC1HDAC2HDAC6TSHRALDH1A1
SCHEMBL23113130 0.84 EPHX2 (0.45) HDAC1HDAC2HDAC6TSHRLMNA
SCHEMBL28909803 0.84 EPHX2 (0.45) HDAC1HDAC2HDAC6TSHRLMNA
SCHEMBL8360181 0.84 EPHX2 (0.45) HDAC1HDAC2HDAC6TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115887763-B Hyaluronic acid-based bio-ink based on peptide dendrimer enhancement and preparation method thereof 南京工业大学 2024-07-16 CN claimed
CN-117757023-A High-salt low-permeability oil reservoir oil displacement agent containing betaine type surfactant and preparation method thereof 西安石油大油气科技有限公司 2024-03-26 CN claimed
CN-114805477-B Synthesis method of L-lysyl-L-tyrosine 武汉桀升生物科技有限公司 2023-07-18 CN claimed
CN-115181404-B Preparation method of modified rice hull fiber/polylactic acid composite material 湖南建工集团有限公司 2023-04-21 CN claimed
CN-115887763-A Peptide-based dendrimer enhanced hyaluronic acid-based bio-ink and preparation method thereof 南京工业大学 2023-04-04 CN claimed
CN-115477734-A Preparation method of intrinsic in-situ self-repairing anticorrosive polymer 北京化工大学 2022-12-16 CN claimed
CN-115232465-A Preparation method of tough self-repairing material capable of realizing self-repairing in seawater 北京化工大学 2022-10-25 CN claimed
CN-115181404-A Preparation method of modified rice hull fiber/polylactic acid composite material 湖南建工集团有限公司 2022-10-14 CN claimed
CN-114805477-A Method for synthesizing L-lysyl-L-tyrosine 武汉桀升生物科技有限公司 2022-07-29 CN claimed
CN-112480122-B Tetrahydroimidazo [1,2-a ] pyrazine compound, composition, preparation method and application thereof 中山大学 2022-03-22 CN claimed
CN-111281983-B Magnetic resonance imaging contrast agent, preparation method and application thereof 中国科学院苏州纳米技术与纳米仿生研究所 2022-02-11 CN claimed
CN-111454457-B Chiral peptide antibacterial polymer with dendrimer as side chain and preparation method thereof 四川大学 2021-03-16 CN claimed
CN-111574740-B Method for modifying surface of SEBS (styrene-ethylene-butylene-styrene) material with efficient bactericidal polymer and modified SEBS material 四川大学 2021-03-16 CN claimed
CN-111574740-A Method for modifying surface of SEBS (styrene-ethylene-butylene-styrene) material with efficient bactericidal polymer and modified SEBS material 四川大学 2020-08-25 CN claimed
CN-111454457-A Chiral peptide antibacterial polymer with dendrimer as side chain and preparation method thereof 四川大学 2020-07-28 CN claimed
CN-111281983-A Magnetic resonance imaging contrast agent, preparation method and application thereof 中国科学院苏州纳米技术与纳米仿生研究所 2020-06-16 CN claimed
CN-110639023-A Novel polymer nano delivery system and preparation method thereof for treating nerve injury 南通大学 2020-01-03 CN claimed
CN-115887763-B Hyaluronic acid-based bio-ink based on peptide dendrimer enhancement and preparation method thereof 南京工业大学 2024-07-16 CN disclosed
WO-2003103671-A1 BASIC NON-PEPTIDE BRADYKININ ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREFROM MENARINI RICERCHE S.P.A. (IT) 2003-12-18 WO disclosed
WO-2002081475-A1 JUN KINASE INHIBITORS EISAI CO., LIMITED (JP) 2002-10-17 WO disclosed