SCHEMBL25853276

SCHEMBL25853276

CC1CC(C)CC(c2ccc(Cl)c(Cc3ccc(CC4CCCC4)cc3)c2)C1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 18/20 0.41
SLC5A1 P13866 15/20 0.41
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KCNH2 Q12809 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
SCHEMBL20124376 0.83 SLC5A2 (0.54) SLC5A2SLC5A1
SCHEMBL21765097 0.81 SLC5A2 (0.44) SLC5A2SLC5A1
SCHEMBL23453177 0.79 SLC5A2 (0.37) SLC5A2SLC5A1
SCHEMBL24981125 0.77 SLC5A2 (0.48) SLC5A2SLC5A1
SCHEMBL25665514 0.76 SLC5A2 (0.49) SLC5A2SLC5A1
SCHEMBL20124375 0.74 SLC5A2 (0.45) SLC5A2SLC5A1
SCHEMBL25852980 0.74 SLC6A2 (0.33) SLC5A2SLC5A1SLC6A2SLC6A4SLC6A3
SCHEMBL24952274 0.74 SLC5A2 (0.36) SLC5A2SLC5A1
SCHEMBL27820660 0.73 SLC5A2 (0.52) SLC5A2SLC5A1
SCHEMBL27358383 0.73 SLC5A2 (0.47) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3634970-B1 NOVEL PROCESS FOR PREPARATION OF EMPAGLIFLOZIN OR ITS CO-CRYSTALS, SOLVATES AND THEIR POLYMORPHS THEREOF LAURUS LABS LTD (IN) 2023-07-19 EP disclosed