SCHEMBL28833702

SCHEMBL28833702

CCN1C=CCC1.COS(=O)(=O)O

nearest known ligand 0.00

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ 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
Trifluoromethanesulfonic Acid SCHEMBL29251736 0.81
SCHEMBL298741 0.80
Fluoride SCHEMBL29252244 0.78
SCHEMBL27980286 0.77
SCHEMBL563226 0.71
SCHEMBL28089492 0.70
SCHEMBL31241428 0.68 GLB1 (0.33)
SCHEMBL5161248 0.68
SCHEMBL27570628 0.67 KMT2A (0.42)
SCHEMBL8426295 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119677491-A Stable detergent compositions with unsaturated zwitterionic surfactants 联合利华知识产权控股有限公司 2025-03-21 CN disclosed
CN-114980978-A Hydratable concentrated surfactant compositions 联合利华知识产权控股有限公司 2022-08-30 CN disclosed