SCHEMBL7793643

SCHEMBL7793643

CC[C@H](OC(C)=O)OC(=O)OC1CCOCC1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
PIK3CD O00329 1/20 0.33
ACACB O00763 1/20 0.32
KAT2B Q92831 1/20 0.31
BAZ2B Q9UIF8 1/20 0.31
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL19228020 0.80 PIK3CD (0.35) PIK3CDACACBKAT2BBAZ2BPDE4A
SCHEMBL7601636 0.80 PIK3CD (0.35) PIK3CDACACBKAT2BBAZ2B
SCHEMBL5987438 0.80 PIK3CD (0.35) PIK3CDACACBKAT2BBAZ2B
SCHEMBL5985348 0.80 PIK3CD (0.35) PIK3CDACACBKAT2BBAZ2B
SCHEMBL7795629 0.78 ALDH1A1 (0.35) ALDH1A1LMNAPIK3CD
SCHEMBL5987441 0.77 PIK3CD (0.33) PIK3CDACACBKAT2BBAZ2B
SCHEMBL7603121 0.77 PIK3CD (0.33) PIK3CDACACBKAT2BBAZ2B
SCHEMBL5987444 0.77 PIK3CD (0.33) PIK3CDACACBKAT2BBAZ2B
SCHEMBL16587944 0.75 KAT2B (0.36) PIK3CDACACBKAT2BBAZ2BL3MBTL1
SCHEMBL73973 0.73 KAT2B (0.42) ALDH1A1PIK3CDACACBKAT2BBAZ2B

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-2010150840-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE 大日本住友製薬株式会社 (JP) 2010-12-29 WO disclosed