SCHEMBL6243245

SCHEMBL6243245

CC1(CCC(=O)O)CCc2cc(O)c3c(c2O1)C1CCC3C1.COC(=O)CCC1(C)CCc2cc(O)c3c(c2O1)C1CCC3C1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 0.40
AKT1 P31749 4/20 0.37
PDPK1 O15530 1/20 0.37
PHLPP1 O60346 1/20 0.37
ILK Q13418 1/20 0.37
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
BCHE P06276 1/20 0.36
NR1I2 O75469 2/20 0.35
PTGES O14684 1/20 0.35

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
SCHEMBL968274 0.96 AKT1 (0.40) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL969041 0.93 ALOX5 (0.44) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL12919844 0.93 ALOX5 (0.44) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL12919845 0.93 ALOX5 (0.44) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL967402 0.92 AKT1 (0.41) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL967545 0.89 AKT1 (0.39) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL969505 0.89 ALOX5 (0.45) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL968256 0.86 ALOX5 (0.43) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL12919862 0.85 ALOX5 (0.43) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL969104 0.82 AKT1 (0.36) ALOX5AKT1PDPK1PHLPP1ILK

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-2005033093-A1 7,8-BICYCLOALKYL-CHROMAN DERIVATIVES GALILEO PHARMACEUTICALS, INC. (US) 2005-04-14 WO disclosed