SCHEMBL2478873

SCHEMBL2478873

CC(=Cc1ccccc1[C@@H](C)OC[C@H]1CO1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.40
AKR1C3 P42330 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
APEX1 P27695 1/20 0.36

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
SCHEMBL2478871 1.00 MGLL (0.40) MGLLAKR1C3TDP1APEX1
SCHEMBL2480356 0.87 MGLL (0.38) MGLLTDP1
SCHEMBL2480359 0.87 MGLL (0.38) MGLLTDP1
SCHEMBL2672628 0.82 MGLL (0.43) MGLLTDP1
SCHEMBL2672634 0.82 MGLL (0.43) MGLLTDP1
SCHEMBL2672639 0.82 MGLL (0.43) MGLLTDP1
SCHEMBL2474133 0.81 MGLL (0.39) MGLLTDP1
SCHEMBL2672425 0.81 PAM (0.39) MGLLTDP1
SCHEMBL2672423 0.81 PAM (0.39) MGLLTDP1
SCHEMBL2474137 0.81 MGLL (0.39) MGLLTDP1

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-2374788-A1 INDANYL COMPOUNDS Daiichi Sankyo Company, Limited (JP) 2011-10-12 EP disclosed
EP-2374794-A1 CYCLIC AMINE COMPOUNDS Daiichi Sankyo Company, Limited (JP) 2011-10-12 EP disclosed