SCHEMBL838666

SCHEMBL838666

CCOC[C@](C)(Oc1ncnc2c1cnn2-c1ncccc1Cl)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.57
KCNH2 Q12809 11/20 0.56

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
SCHEMBL838214 0.88 GCK (0.45) GCKKCNH2
SCHEMBL838428 0.82 GCK (0.47) GCKKCNH2
SCHEMBL3125949 0.80 GCK (0.76) GCKKCNH2
SCHEMBL840175 0.78 GCK (0.78) GCKKCNH2
SCHEMBL838663 0.78 GCK (0.78) GCKKCNH2
SCHEMBL838665 0.76 GCK (0.73) GCKKCNH2
SCHEMBL838664 0.76 GCK (0.59) GCKKCNH2
SCHEMBL839611 0.75 GCK (0.45) GCKKCNH2
SCHEMBL838202 0.73 GCK (1.00) GCKKCNH2
SCHEMBL839158 0.73 GCK (0.76) GCKKCNH2

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
US-8143263-B2 Therapeutic agents ASTRAZENECA AB (SE) 2012-03-27 US disclosed