SCHEMBL20162301

SCHEMBL20162301

Cn1cc[n+](CCCCS(=O)(=O)O)c1.[H+]

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
GLA P06280 1/20 0.31
PKM P14618 1/20 0.31
APP P05067 1/20 0.31

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
SCHEMBL34496 0.98 APP (0.31) KDM4EGLAPKMAPP
Hydrochloric Acid SCHEMBL35022 0.97 KDM4E (0.31) KDM4EGLAPKMAPP
Bromide SCHEMBL34515 0.97 KDM4E (0.31) KDM4EGLAPKMAPP
Sulfuric Acid SCHEMBL12544523 0.95
Sulfuric Acid SCHEMBL12544527 0.94 KDM4E (0.30) KDM4E
SCHEMBL15837162 0.93 APP (0.32) KDM4EAPP
SCHEMBL34671 0.92
SCHEMBL34898 0.92
Hydrochloric Acid SCHEMBL16246027 0.92 APP (0.31) APP
SCHEMBL34859 0.91 PABPC1 (0.31)

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
EP-3322527-A1 METHOD FOR PREPARING BIOSOURCED IONIC LIQUIDS FOR CATALYSIS Université de Bourgogne (FR) 2018-05-23 EP disclosed