SCHEMBL20124711

SCHEMBL20124711

CC(=O)N(Cc1ccc(Cc2cc(C3CC(OCc4ccccc4)CC(COCc4ccccc4)O3)ccc2Cl)cc1)C1CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 14/20 0.40
DPP4 P27487 1/20 0.36
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
SLC5A1 P13866 9/20 0.34
DRD2 P14416 1/20 0.34
DRD1 P21728 1/20 0.34
DRD5 P21918 1/20 0.34
SLC6A4 P31645 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A3 Q01959 1/20 0.33

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
SCHEMBL20124636 0.82 SLC5A2 (0.43) SLC5A2SLC5A1
SCHEMBL20124655 0.82 SLC5A2 (0.40) SLC5A2SLC5A1
SCHEMBL500174 0.82 SLC5A2 (0.43) SLC5A2DPP4DPP9DPP7SLC5A1
SCHEMBL20124674 0.80 SLC5A2 (0.44) SLC5A2SLC5A1
SCHEMBL20643060 0.80 SLC5A2 (0.37) SLC5A2SLC5A1DRD1
SCHEMBL20643023 0.79 SLC5A2 (0.47) SLC5A2SLC5A1
SCHEMBL20643064 0.78 SLC5A2 (0.47) SLC5A2SLC5A1
SCHEMBL20643061 0.78 HRH4 (0.36) SLC5A2DRD1
SCHEMBL20124721 0.78 SLC5A2 (0.39) SLC5A2SLC5A1
SCHEMBL20124719 0.77 SLC5A2 (0.46) SLC5A2SLC5A1DRD2DRD1DRD5

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-3318562-A2 BENZYLBENZENE DERIVATIVES AND METHODS OF USE Theracos Sub, LLC (US) 2018-05-09 EP disclosed