SCHEMBL20569336

SCHEMBL20569336

CCOC(=O)C1(NCCN(C)C(=O)OC(C)(C)C)CC1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FPR3 P25089 1/20 0.37
FPR2 P25090 1/20 0.37
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
CA14 Q9ULX7 1/20 0.32
AHCY P23526 1/20 0.31
AAK1 Q2M2I8 1/20 0.31
GPR88 Q9GZN0 1/20 0.31
CPB2 Q96IY4 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
SCHEMBL29239791 0.80 SMN1; SMN2 (0.34)
SCHEMBL4151262 0.75 GAA (0.34) FPR2NFKB1NFKB2RELA
SCHEMBL23849109 0.75 FPR3 (0.39) FPR3FPR2NFKB1NFKB2RELA
SCHEMBL29239790 0.75 DNM1 (0.36)
SCHEMBL4144318 0.73 NFKB1 (0.37) NFKB1NFKB2RELACPB2
SCHEMBL22303932 0.73 NFKB1 (0.43) NFKB1NFKB2RELACA14
SCHEMBL30999446 0.73 FPR3 (0.39) FPR3FPR2CA14AAK1
SCHEMBL30999452 0.73 FPR3 (0.39) FPR3FPR2CA14AAK1
SCHEMBL8716878 0.72 GAA (0.36)
SCHEMBL5347434 0.72 ALDH1A1 (0.38) FPR3FPR2NFKB1NFKB2RELA

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-2018216822-A1 NOVEL IMIDAZOLE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2018-11-29 WO disclosed