SCHEMBL2321676

SCHEMBL2321676

Cc1ccc(-c2ccc(N[C]=O)nc2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.41
CHRNA7 P36544 1/20 0.41
ABL1 P00519 12/20 0.39
KMO O15229 2/20 0.39
ABCB1 P08183 2/20 0.38
ABCC1 P33527 1/20 0.38
KCNQ3 O43525 1/20 0.37
KCNQ2 O43526 1/20 0.37
KCNE1 P15382 1/20 0.37
KCNQ1 P51787 1/20 0.37
KCNQ5 Q9NR82 1/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 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
SCHEMBL2324956 0.82 EPHB4 (0.46) KMO
SCHEMBL2327125 0.82 WNT3A (0.47) ABCB1
SCHEMBL2321685 0.79 KIF11 (0.41) KIF11CHRNA7ABL1KMO
SCHEMBL2360145 0.78 KDR (0.46) ABCB1
SCHEMBL2360450 0.78 EGLN1 (0.44)
SCHEMBL2318868 0.73 HIF1A (0.47) ABL1
SCHEMBL2317975 0.73 DEGS1 (0.46)
SCHEMBL2320830 0.72 CNR2 (0.44)
SCHEMBL15889943 0.71 MAP4K4 (0.51) CHRNA7ABL1
SCHEMBL2320050 0.71 DEGS1 (0.49)

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
WO-2011094890-A1 PHENYLALANINE DERIVATIVES AND THEIR USE AS NON-PEPTIDE GLP-1 RECEPTOR MODULATORS ARGUSINA INC. (US) 2011-08-11 WO disclosed