SCHEMBL6458927

SCHEMBL6458927

CCCCCC1CCC2CC(c3ccc4cc(OC(F)F)c(F)cc4c3)CCC2C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31

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
SCHEMBL6458920 1.00 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3
SCHEMBL6451401 0.99 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL6451409 0.99 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL6452879 0.99 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL6452871 0.99 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL6452541 0.97 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3
SCHEMBL6452545 0.97 SLC6A2 (0.31) SLC6A2SLC6A4SLC6A3
SCHEMBL6451594 0.93 SLC6A4 (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL6451598 0.93 SLC6A4 (0.32) SLC6A2SLC6A4SLC6A3
SCHEMBL6458402 0.89 KDM1A (0.34) SLC6A2SLC6A4SLC6A3

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