SCHEMBL28262175

SCHEMBL28262175

CC(C)C[C@H](OC(=O)NC(C)(C)C)C(N)=S

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.36
LAP3 P28838 2/20 0.33
POLB P06746 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SCN9A Q15858 1/20 0.31
EPHX1 P07099 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
SCHEMBL7308675 0.81 FOLH1 (0.53) FOLH1LAP3POLBALDH1A1SCN9A
SCHEMBL3222189 0.77 POLB (0.37) FOLH1LAP3POLBSCN9A
SCHEMBL27858273 0.77 FOLH1 (0.36) FOLH1LAP3POLBSCN9A
SCHEMBL3222193 0.77 POLB (0.37) FOLH1LAP3POLBSCN9A
SCHEMBL29120907 0.76 FOLH1 (0.35) FOLH1POLBSCN9A
SCHEMBL27753796 0.76 SLC7A5 (0.36) FOLH1LAP3POLB
SCHEMBL29052563 0.75 FOLH1 (0.33) FOLH1
SCHEMBL27910718 0.75 CTSK (0.38) LAP3POLB
SCHEMBL27726431 0.75 CTSK (0.38) LAP3POLB
SCHEMBL27834093 0.75 CTSK (0.38) LAP3POLB

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-106349156-B It can be used as the pyridine -2- amides of CB2 agonist 霍夫曼-拉罗奇有限公司 2018-12-11 CN disclosed