SCHEMBL17994

SCHEMBL17994

COC1(c2ccc(Cl)c(Cc3ccc(OCC4(C(F)(F)F)CCC4)cc3)c2)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 19/20 0.46
SLC5A1 P13866 13/20 0.46
ADRA2A P08913 1/20 0.43
SLC5A11 Q8WWX8 1/20 0.43

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
SCHEMBL26929 1.00 SLC5A2 (0.46) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL18653 0.97 SLC5A2 (0.47) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL25985 0.97 SLC5A2 (0.47) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL25568 0.91 SLC5A2 (0.40) SLC5A2SLC5A1
SCHEMBL29354 0.87 SLC5A2 (0.41) SLC5A2SLC5A1
SCHEMBL17924 0.87 SLC5A2 (0.41) SLC5A2SLC5A1
SCHEMBL18181 0.87 SLC5A2 (0.54) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL28395 0.87 SLC5A2 (0.54) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL18730 0.87 SLC5A2 (0.53) SLC5A2SLC5A1ADRA2ASLC5A11
SCHEMBL15477346 0.86 SLC5A2 (0.50) SLC5A2SLC5A1ADRA2ASLC5A11

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