SCHEMBL4315433

SCHEMBL4315433

CCC1CNCCN1C(C)S(=O)(=O)O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 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
SCHEMBL8322161 0.85 CA1 (0.41)
Ammonia Solution, Strong SCHEMBL28608746 0.82
SCHEMBL9559746 0.78 SMN1; SMN2 (0.30)
SCHEMBL14085848 0.78 SLC6A2 (0.30)
SCHEMBL3105807 0.78 SLC6A2 (0.30)
SCHEMBL27551532 0.78
Hydrochloric Acid SCHEMBL28058909 0.76
Hydrochloric Acid SCHEMBL28320675 0.76
SCHEMBL9155653 0.76
SCHEMBL2257967 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009135537-A1 METHOD FOR ENZYMATIC ASSESSMENT OF THE TOXICITY OF ENVIRONMENTAL AQUEOUS MATRICES UNIVERSITA' DEL SALENTO (IT) 2009-11-12 WO claimed