SCHEMBL17008175

SCHEMBL17008175

C=CCC(CC=C)C(C)OS(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL17008172 0.83
SCHEMBL9742365 0.78 CA1 (0.31)
SCHEMBL2833421 0.71
SCHEMBL777650 0.70
SCHEMBL27244619 0.69
SCHEMBL19285150 0.67
SCHEMBL839597 0.67
SCHEMBL780039 0.67
SCHEMBL9398116 0.67
SCHEMBL778429 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3106507-A1 LIQUID LAUNDRY DETERGENT COMPOSITION FOR CLOTHING Lonza Ltd (CH) 2016-12-21 EP disclosed
CN-105980539-A Liquid laundry detergent composition for clothing 隆萨有限公司 2016-09-28 CN disclosed
WO-2015122360-A1 LIQUID LAUNDRY DETERGENT COMPOSITION FOR CLOTHING ロンザジャパン株式会社 2015-08-20 WO disclosed