SCHEMBL2480035

SCHEMBL2480035

CCC(=Cc1c(F)cccc1[C@@H](C)OCC1CO1)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.32
MGLL Q99685 3/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL2480037 1.00 EPHX2 (0.32) EPHX2MGLLSMN1; SMN2
SCHEMBL2473954 0.89 ALDH1A1 (0.33) EPHX2MGLL
SCHEMBL2473955 0.89 ALDH1A1 (0.33) EPHX2MGLL
SCHEMBL2477699 0.87 EPHX2 (0.41) EPHX2SMN1; SMN2
SCHEMBL2477700 0.87 EPHX2 (0.41) EPHX2SMN1; SMN2
SCHEMBL2480356 0.84 MGLL (0.38) MGLL
SCHEMBL2480359 0.84 MGLL (0.38) MGLL
SCHEMBL2673084 0.82 MGLL (0.37) MGLLSMN1; SMN2
SCHEMBL2673078 0.82 MGLL (0.37) MGLLSMN1; SMN2
SCHEMBL2673081 0.82 MGLL (0.37) MGLLSMN1; SMN2

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