SCHEMBL6460171

SCHEMBL6460171

CCCCCC1CCC2CC(c3ccc(-c4ccc(F)c(F)c4)c(F)c3)CCC2C1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.35
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
GCGR P47871 1/20 0.31
RARB P10826 1/20 0.31
PDE5A O76074 1/20 0.31
AXL P30530 2/20 0.30
TYRO3 Q06418 2/20 0.30
MERTK Q12866 2/20 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
SCHEMBL6460167 1.00 FASN (0.35) FASNCYP11B1CYP11B2GAAMAPT
SCHEMBL6458633 0.99 FASN (0.34) FASNCYP11B1CYP11B2GAAMAPT
SCHEMBL6454089 0.99 FASN (0.34) FASNCYP11B1CYP11B2GAAMAPT
SCHEMBL6454084 0.99 FASN (0.34) FASNCYP11B1CYP11B2GAAMAPT
SCHEMBL6458629 0.99 FASN (0.34) FASNCYP11B1CYP11B2GAAMAPT
SCHEMBL6459811 0.97 FASN (0.35) FASNCYP11B1CYP11B2AXLTYRO3
SCHEMBL6459809 0.97 FASN (0.35) FASNCYP11B1CYP11B2AXLTYRO3
SCHEMBL6457917 0.92 FASN (0.36) FASNCYP11B1CYP11B2MAPT
SCHEMBL6457908 0.92 FASN (0.36) FASNCYP11B1CYP11B2MAPT
SCHEMBL6458156 0.91 CYP11B1 (0.35) FASNCYP11B1CYP11B2

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
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed