SCHEMBL2652270

SCHEMBL2652270

CC(C)COc1cc(F)ccc1NC(=O)CC(=O)Nc1nc(C(N)S(C)(=O)=O)c(Br)s1.CC(C)COc1cc(F)ccc1NC(=O)CC(=O)Nc1nc(CNS(C)(=O)=O)c(Cl)s1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GCK P35557 2/20 0.35
MKNK2 Q9HBH9 3/20 0.31
GRM4 Q14833 1/20 0.31
MYC P01106 1/20 0.30
MAX P61244 1/20 0.30

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
SCHEMBL2652271 0.92 GCK (0.38) GCKMKNK2MYCMAX
SCHEMBL1343155 0.91 GCK (0.41) GCKMKNK2MYCMAX
SCHEMBL1342712 0.90 ALDH1A1 (0.35) MKNK2GRM4MYCMAX
SCHEMBL1342715 0.88 MKNK2 (0.36) GCKMKNK2
SCHEMBL1343153 0.88 ALDH1A1 (0.36) GCKMKNK2GRM4MYCMAX
SCHEMBL2650841 0.85 SMN1; SMN2 (0.32) GRM4
SCHEMBL1343475 0.84 GCK (0.42) GCKMKNK2MYCMAX
SCHEMBL2650118 0.83 GCK (0.33) GCKMKNK2GRM4
SCHEMBL1342440 0.83 MYC (0.35) MKNK2GRM4MYCMAX
SCHEMBL1343008 0.82 MAPT (0.38) MYCMAX

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-1531815-A1 GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2005-05-25 EP disclosed
WO-2004002481-A1 ARYL CARBONYL DERIVATIVES AS THERAPEUTIC AGENTS NOVO NORDISK A/S (DK) 2004-01-08 WO disclosed