SCHEMBL20154941

SCHEMBL20154941

BC1(B)Cc2ccc(Cc3cc(C4CC(O)CC(CO)O4)c(OC)cc3C)cc21

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 20/20 0.51
SLC5A1 P13866 17/20 0.51
CYP3A4 P08684 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
SCHEMBL20155212 0.94 SLC5A2 (0.52) SLC5A2SLC5A1CYP3A4
SCHEMBL20154885 0.88 SLC5A1 (0.48) SLC5A2SLC5A1
SCHEMBL20154938 0.87 SLC5A2 (0.49) SLC5A2SLC5A1
SCHEMBL20155549 0.87 SLC5A2 (0.66) SLC5A2SLC5A1
SCHEMBL20154944 0.85 SLC5A2 (0.52) SLC5A2SLC5A1
SCHEMBL20155230 0.85 SLC5A2 (0.49) SLC5A2SLC5A1
SCHEMBL20155267 0.81 SLC5A2 (0.41) SLC5A2SLC5A1
SCHEMBL26764163 0.81 SLC5A2 (0.52) SLC5A2SLC5A1CYP3A4
SCHEMBL22590705 0.80 SLC5A2 (0.75) SLC5A2SLC5A1
SCHEMBL20154888 0.79 SLC5A2 (0.49) 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
WO-2018089449-A1 BENZOCYCLOBUTANE DERIVATIVES USEFUL AS DUAL SGLT1/SGLT2 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-17 WO disclosed