SCHEMBL5547388

SCHEMBL5547388

CCN(O)CC.COS(=O)(=O)O

nearest known ligand 0.32

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.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.32
USP2 O75604 1/20 0.32
TSHR P16473 1/20 0.32
CA1 P00915 1/20 0.30

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
SCHEMBL1229989 0.84 CA2 (0.32) CA2USP2TSHRCA1
Sulfuric Acid SCHEMBL1871310 0.83 CA5A (0.40) CA1
Sulfuric Acid SCHEMBL1329719 0.83 CA5A (0.40) CA1
N,N-Dimethylethanaminium SCHEMBL9980776 0.81 CA2 (0.33) CA2USP2TSHRCA1
SCHEMBL444614 0.81 NPSR1 (0.36) CA2USP2TSHRCA1
SCHEMBL5551705 0.80 CA1 (0.39) CA2CA1
Propane SCHEMBL2200005 0.80
SCHEMBL28002339 0.80 CA2 (0.41) CA2USP2TSHRCA1
SCHEMBL17509696 0.79 CA2 (0.32) CA2USP2TSHRCA1
Trimethylammonium SCHEMBL348029 0.78 CA2 (0.35) CA2USP2TSHRCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112538758-A Fabric care compositions with softening, antistatic, and shade drying odor removal properties 上海家化联合股份有限公司 2021-03-23 CN disclosed
CN-108743440-A Composition for dyeing keratinous fibres 莱雅公司 2018-11-06 CN disclosed
CN-107412005-A Composition for dyeing keratinous fibres 莱雅公司 2017-12-01 CN disclosed
WO-2007063327-A1 HYDROXYLAMMONIUM SALTS AS IONIC LIQUIDS BIONIQS LIMITED (GB) 2007-06-07 WO disclosed