SCHEMBL2477017

SCHEMBL2477017

CCC(=Cc1cc(F)ccc1[C@@H](C)OCC1CO1)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.32
AKR1B1 P15121 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
EPHX2 P34913 1/20 0.31
GRM7 Q14831 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
SCHEMBL2477018 1.00 PPARG (0.32) PPARGAKR1B1PSEN1PSEN2APH1B
SCHEMBL2478856 0.94 MGLL (0.33) PPARGAKR1B1PSEN1PSEN2APH1B
SCHEMBL2478852 0.94 MGLL (0.33) PPARGAKR1B1PSEN1PSEN2APH1B
SCHEMBL2476679 0.89 SRC (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2476683 0.89 SRC (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2481306 0.88 FFAR1 (0.35)
SCHEMBL2481308 0.88 FFAR1 (0.35)
SCHEMBL2481311 0.88 FFAR1 (0.35)
SCHEMBL2477146 0.88 PSEN1 (0.40) PPARGPSEN1PSEN2APH1BNCSTN
SCHEMBL2477143 0.88 PSEN1 (0.40) PPARGPSEN1PSEN2APH1BNCSTN

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