SCHEMBL27894286

SCHEMBL27894286

CC(C)(CC(C)(C=O)c1cc(Br)ccc1F)OC(N)=O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ AAK1 Q2M2I8 2/20 0.32
▸ RBP4 P02753 1/20 0.31

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
SCHEMBL27911493 0.81 DGAT1 (0.36) DGAT1PTGDR2AAK1RBP4
SCHEMBL27911496 0.79 DGAT1 (0.34) DGAT1PTGDR2AAK1RBP4
SCHEMBL12614516 0.77 DGAT1 (0.44) DGAT1PTGDR2AAK1RBP4
SCHEMBL27698022 0.71 DGAT1 (0.44) DGAT1AAK1
SCHEMBL27828850 0.70 RAB9A (0.38) PTGDR2AAK1
SCHEMBL27808403 0.70 OGG1 (0.37) —
SCHEMBL6923396 0.70 DGAT1 (0.36) DGAT1PTGDR2
SCHEMBL28228164 0.69 PTGDR2 (0.46) DGAT1PTGDR2AAK1RBP4
SCHEMBL245821 0.68 AAK1 (0.48) PTGDR2AAK1
SCHEMBL16435370 0.68 AAK1 (0.48) PTGDR2AAK1

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
CN-102985412-A 3-amino-5,6-dihydro-1h-pyrazin-2-one derivatives useful for the treatement of alzheimer's disease and other forms of dementia JANSSEN PHARMACEUTICA NV 2013-03-20 — — CN disclosed
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