SCHEMBL14435779

SCHEMBL14435779

CS(=O)(=O)c1ccc([C@H](CC2CCC(=NO)CC2)C(=O)Nc2cnc(Br)cn2)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.63
GCK P35557 16/20 0.60
FFAR2 O15552 1/20 0.36

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
SCHEMBL2641959 1.00 KCNH2 (0.63) KCNH2GCKFFAR2
SCHEMBL14423153 1.00 KCNH2 (0.63) KCNH2GCKFFAR2
SCHEMBL2642342 1.00 KCNH2 (0.63) KCNH2GCKFFAR2
SCHEMBL2642077 0.95 GCK (0.63) KCNH2GCKFFAR2
SCHEMBL2642074 0.95 GCK (0.63) KCNH2GCKFFAR2
SCHEMBL14423144 0.95 GCK (0.63) KCNH2GCKFFAR2
SCHEMBL2642082 0.92 KCNH2 (0.64) KCNH2GCKFFAR2
SCHEMBL2642084 0.92 KCNH2 (0.64) KCNH2GCKFFAR2
SCHEMBL2642212 0.92 KCNH2 (0.64) KCNH2GCKFFAR2
SCHEMBL2642211 0.92 KCNH2 (0.64) KCNH2GCKFFAR2

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-7259166-B2 Substituted-cycloalkyl and oxygenated-cycloalkyl glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2007-08-21 US disclosed