SCHEMBL20643121

SCHEMBL20643121

CCc1ccc(Cc2cc(C3CC(OCc4ccccc4)CC(COCc4ccccc4)O3)cc(O)c2Cl)cc1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 14/20 0.37
SLC5A1 P13866 9/20 0.34
DRD1 P21728 1/20 0.33
HRH4 Q9H3N8 4/20 0.32
HRH3 Q9Y5N1 4/20 0.32
HSP90AA1 P07900 1/20 0.32

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
SCHEMBL20643136 0.92 SLC5A2 (0.47) SLC5A2SLC5A1
SCHEMBL20643041 0.89 SLC5A2 (0.38) SLC5A2SLC5A1HRH4HRH3
SCHEMBL20643026 0.84 SLC5A2 (0.36) SLC5A2SLC5A1DRD1
SCHEMBL20643052 0.83 SLC5A2 (0.36) SLC5A2SLC5A1DRD1
SCHEMBL20643044 0.81 SLC5A2 (0.49) SLC5A2SLC5A1
SCHEMBL20643031 0.79 SLC5A2 (0.49) SLC5A2SLC5A1
SCHEMBL20643090 0.79 SLC5A2 (0.50) SLC5A2SLC5A1
SCHEMBL20124636 0.78 SLC5A2 (0.43) SLC5A2SLC5A1
SCHEMBL20643055 0.78 SLC5A2 (0.44) SLC5A2SLC5A1
SCHEMBL15610567 0.78 TACR2 (0.40) 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-2714032-B1 NOVEL DIPHENYLMETHANE DERIVATIVES AS SGLT2 INHIBITORS GREEN CROSS CORP (KR) 2019-01-16 EP disclosed