SCHEMBL17859644

SCHEMBL17859644

Cc1ccc(Cl)c(Cc2ccc(O[C@@H]3CCOC3)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 17/20 0.59
SLC5A1 P13866 10/20 0.59
PDE2A O00408 2/20 0.41
PDE10A Q9Y233 2/20 0.41
HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL14949150 1.00 SLC5A2 (0.59) SLC5A2SLC5A1PDE2APDE10AHRH3
SCHEMBL17189332 0.88 SLC5A2 (0.59) SLC5A2SLC5A1PDE2APDE10A
SCHEMBL14949125 0.88 SLC5A2 (0.46) SLC5A2SLC5A1HRH3
SCHEMBL15682904 0.88 SLC5A2 (0.46) SLC5A2SLC5A1HRH3
SCHEMBL30830341 0.88 SLC5A2 (0.61) SLC5A2SLC5A1PDE2APDE10AHRH3
SCHEMBL14949153 0.88 SLC5A2 (0.46) SLC5A2SLC5A1HRH3
SCHEMBL19189964 0.87 SLC5A2 (0.60) SLC5A2SLC5A1PDE2APDE10AHRH3
SCHEMBL28981278 0.86 SLC5A2 (0.57) SLC5A2SLC5A1PDE2APDE10A
SCHEMBL28981279 0.86 SLC5A2 (0.57) SLC5A2SLC5A1PDE2APDE10A
SCHEMBL3465613 0.86 SLC5A2 (0.59) SLC5A2SLC5A1PDE2APDE10AHRH3

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-2016098016-A1 PROCESS FOR THE PREPARATION OF SGLT2 INHIBITORS DR. REDDY’S LABORATORIES LIMITED (IN) 2016-06-23 WO disclosed