SCHEMBL29528259

SCHEMBL29528259

CCCCCC(C)C#CC(=O)O.CCCCCCC#CC(=O)OC

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.41
PTPN7 P35236 4/20 0.39
ZDHHC7 Q9NXF8 1/20 0.37
RECQL P46063 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD17B10 Q99714 1/20 0.36
EPHX2 P34913 1/20 0.35
ACE2 Q9BYF1 1/20 0.35
GPR84 Q9NQS5 2/20 0.34

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
SCHEMBL29402864 0.96 HMGCR (0.36) HMGCRPTPN7ZDHHC7RECQLTDP1
SCHEMBL30842583 0.84 PTPN7 (0.49) HMGCRPTPN7RECQLTDP1MEN1
SCHEMBL2491510 0.84 ZDHHC7 (0.46) ZDHHC7RECQLMEN1HPGDKMT2A
SCHEMBL7547647 0.83 PTPN7 (0.46) HMGCRPTPN7RECQLTDP1MEN1
SCHEMBL29527799 0.82 ACE2 (0.51) HMGCRPTPN7ZDHHC7ACE2GPR84
Bicarbonate SCHEMBL29385221 0.82 HMGCR (0.44) HMGCRPTPN7RECQLTDP1MEN1
Bicarbonate SCHEMBL29380342 0.82 PTPN7 (0.45) HMGCRPTPN7RECQLTDP1MEN1
Bicarbonate SCHEMBL1867009 0.81 PTPN7 (0.52) HMGCRPTPN7RECQLTDP1MEN1
SCHEMBL9336107 0.81 PTPN7 (0.50) HMGCRPTPN7ZDHHC7RECQLTDP1
SCHEMBL31317692 0.81 PTPN7 (0.50) HMGCRPTPN7ZDHHC7RECQLTDP1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117794383-A Fragrance or flavor composition for pets 西姆莱斯股份公司 2024-03-29 CN claimed
CN-119584860-A Comprising biodegradable microcapsule composition 奇华顿股份有限公司 2025-03-07 CN disclosed
CN-118974230-A Fabric care compositions 奇华顿股份有限公司 2024-11-15 CN disclosed
CN-118369412-A Solid composition 奇华顿股份有限公司 2024-07-19 CN disclosed
CN-118251271-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2024-06-25 CN disclosed
CN-118119691-A Composition and method for producing the same 奇华顿股份有限公司 2024-05-31 CN disclosed
CN-117836397-A Smell cancellation 奇华顿股份有限公司 2024-04-05 CN disclosed
CN-117794635-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2024-03-29 CN disclosed
CN-116507709-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2023-07-28 CN disclosed
CN-116457084-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2023-07-18 CN disclosed
CN-115702234-A Environment-friendly solvent, and washing composition and washing device comprising same 株式会社LG生活健康 2023-02-14 CN disclosed
CN-114269888-A Fragrance enhancing compositions 阿尔门德拉私人有限公司 2022-04-01 CN disclosed