SCHEMBL14964867

SCHEMBL14964867

C[n+]1c(CS(=O)(=O)[O-])cccc1CS(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 14/20 0.42
ACHE P22303 5/20 0.39
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL14964869 1.00 KCNH2 (0.42) KCNH2ACHECA12CA2CA9
SCHEMBL14964868 0.90 KCNH2 (0.42) KCNH2ACHE
Phenylmethanesulfonic Acid SCHEMBL30041177 0.65 CA2 (0.47) CA12CA2CA9
SCHEMBL13108626 0.64 KCNH2 (0.48) KCNH2
Sulfuric Acid SCHEMBL1712638 0.63 THRB (0.35) KCNH2ACHECA12CA9
SCHEMBL14964904 0.62 TSHR (0.32) KCNH2ACHE
SCHEMBL14964902 0.62 TSHR (0.32) KCNH2ACHE
Phenylmethanesulfonic Acid SCHEMBL20543167 0.61 CA2 (0.57) CA12CA2CA9
SCHEMBL19458253 0.61 KCNH2 (0.54) KCNH2
SCHEMBL14964903 0.60 TSHR (0.39)

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
WO-2013072470-A1 ANIONS AND DERIVED SALTS WITH HIGH DISSOCIATION IN NON-PROTOGENIC SOLVENTS JONSSON ERLENDUR (SE) 2013-05-23 WO claimed
US-9269987-B2 Anions and derived salts with high dissociation in non-protogenic solvents JÓNSSON ERLENDUR (SE) 2016-02-23 US disclosed
US-20140272601-A1 Anions and Derived Salts with High Dissociation in Non-Protogenic Solvents JÓNSSON ERLENDUR (SE) 2014-09-18 US disclosed