SCHEMBL5181920

SCHEMBL5181920

CN(c1ccc2c(c1)nc(C(C)(C)C)n2CC1CCC(F)(F)CC1)S(=O)(=O)N1CCC(F)(F)CC1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.62
CNR1 P21554 6/20 0.62
KCNH2 Q12809 1/20 0.53

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
SCHEMBL5181277 0.96 CNR2 (0.59) CNR2CNR1KCNH2
SCHEMBL5181212 0.96 CNR2 (0.61) CNR2CNR1KCNH2
SCHEMBL5179673 0.95 CNR2 (0.60) CNR2CNR1KCNH2
SCHEMBL5181581 0.93 CNR2 (0.60) CNR2CNR1
SCHEMBL5182040 0.93 CNR2 (0.59) CNR2CNR1KCNH2
SCHEMBL5179925 0.93 CNR2 (0.59) CNR2CNR1KCNH2
SCHEMBL5181672 0.93 CNR2 (0.59) CNR2CNR1KCNH2
SCHEMBL5181670 0.91 CNR2 (0.56) CNR2CNR1KCNH2
SCHEMBL5181950 0.89 CNR2 (0.56) CNR2CNR1KCNH2
SCHEMBL5181403 0.89 CNR2 (0.56) CNR2CNR1KCNH2

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
EP-1797070-A1 COMPOUNDS, COMPOSITIONS CONTAINING THEM, PREPARATIONS THEREOF AND USES THEREOF II AstraZeneca AB (SE) 2007-06-20 EP disclosed
WO-2006033633-A1 COMPOUNDS, COMPOSITIONS CONTAINING THEM, PREPARATIONS THEREOF AND USES THEREOF II ASTRAZENECA AB (SE) 2006-03-30 WO disclosed