SCHEMBL18178

SCHEMBL18178

FC(F)(F)C1(COc2ccc(Cc3cc(Br)ccc3Cl)cc2)CCC1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 17/20 0.39
SLC5A1 P13866 9/20 0.39
CCR5 P51681 1/20 0.37
SCN9A Q15858 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
SCHEMBL17483 0.95 SLC5A2 (0.40) SLC5A2SLC5A1CCR5
SCHEMBL18722 0.87 CCR5 (0.37) SLC5A2SLC5A1CCR5SCN9A
SCHEMBL18062 0.82 CCR5 (0.39) SLC5A2SLC5A1CCR5SCN9A
SCHEMBL17334 0.81 SLC5A2 (0.38) SLC5A2SLC5A1
SCHEMBL18040 0.80 SLC5A2 (0.45) SLC5A2SLC5A1
SCHEMBL18072 0.79 HPGD (0.46) SLC5A2SLC5A1
SCHEMBL23912 0.78 SLC5A2 (0.38) SLC5A2SLC5A1
SCHEMBL14954721 0.78 PPARA (0.39) SLC5A2SLC5A1CCR5
SCHEMBL17356 0.77 SLC5A2 (0.38) SLC5A2SLC5A1
SCHEMBL17831 0.77 SLC5A2 (0.43) SLC5A2SLC5A1

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
WO-2012025857-A1 CYCLOALKYL METHOXYBENZYL PHENYL PYRAN DERIVATIVES AS SODIUM DEPENDENT GLUCOSE CO TRANSPORTER (SGLT2) INHIBITORS HETERO RESEARCH FOUNDATION (IN) 2012-03-01 WO disclosed
WO-2012025857-A1 CYCLOALKYL METHOXYBENZYL PHENYL PYRAN DERIVATIVES AS SODIUM DEPENDENT GLUCOSE CO TRANSPORTER (SGLT2) INHIBITORS HETERO RESEARCH FOUNDATION (IN) 2012-03-01 WO disclosed