SCHEMBL1667407

SCHEMBL1667407

CCOC(=O)C1CC(C)CCC1C(=O)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
PKM P14618 1/20 0.45
GAA P10253 1/20 0.43
SLC6A3 Q01959 1/20 0.43
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CCR8 P51685 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 2/20 0.39

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
SCHEMBL12438413 0.87 MAPT (0.48) MAPTPKMSLC6A3TSHRALDH1A1
SCHEMBL18828251 0.82 TRPM8 (0.50) MAPTPKMALDH1A1
SCHEMBL14189731 0.82 TRPM8 (0.50) MAPTPKMALDH1A1
SCHEMBL20073034 0.82 TRPM8 (0.50) MAPTPKMALDH1A1
SCHEMBL233023 0.82 TRPM8 (0.50) MAPTPKMALDH1A1
SCHEMBL14189736 0.82 TRPM8 (0.50) MAPTPKMALDH1A1
SCHEMBL3172897 0.80 ELANE (0.53) GAASLC6A3ALDH1A1NPC1RAB9A
SCHEMBL17852174 0.79 TRPM8 (0.46) MAPTPKM
SCHEMBL11582365 0.77 ALDH1A1 (0.52) MAPTPKMTSHRALDH1A1RAB9A
SCHEMBL14465136 0.77 TRPM8 (0.47) MAPTPKM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2307476-A1 ASYMMETRIC CYCLIC DIESTER COMPOUNDS FERRO CORPORATION (US) 2011-04-13 EP disclosed
WO-2009152068-A1 ASYMMETRIC CYCLIC DIESTER COMPOUNDS FERRO CORPORATION (US) 2009-12-17 WO disclosed