SCHEMBL6446339

SCHEMBL6446339

NC(=O)c1ccc(Br)cc1OC1CCNCC1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 3/20 0.58
MKNK2 Q9HBH9 3/20 0.58
MAP3K5 Q99683 1/20 0.51
SLC6A4 P31645 4/20 0.47
HTR6 P50406 1/20 0.46
DGAT1 O75907 1/20 0.44

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
SCHEMBL16828784 0.90 MKNK1 (0.51) MKNK1MKNK2MAP3K5SLC6A4HTR6
SCHEMBL23889124 0.84 DGAT1 (0.45) MKNK1MKNK2SLC6A4DGAT1
SCHEMBL20646901 0.84 DGAT1 (0.45) MKNK1MKNK2SLC6A4DGAT1
SCHEMBL6451281 0.83 MKNK1 (0.58) MKNK1MKNK2MAP3K5SLC6A4
SCHEMBL6456150 0.83 MKNK1 (0.58) MKNK1MKNK2MAP3K5
SCHEMBL4233748 0.81 MKNK1 (0.58) MKNK1MKNK2MAP3K5
SCHEMBL6447930 0.81 MKNK1 (0.56) MKNK1MKNK2MAP3K5
SCHEMBL6450267 0.81 MAP3K5 (0.61) MKNK1MKNK2MAP3K5SLC6A4
SCHEMBL15566704 0.77 MAP3K5 (0.54) MKNK1MKNK2MAP3K5
SCHEMBL19128145 0.76 DGAT1 (0.43) MKNK1MKNK2SLC6A4DGAT1

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-6964974-B2 2,3-oxidosqualene-lanosterol cyclase inhibitors HOFFMANN-LA ROCHE INC. (US) 2005-11-15 US disclosed