SCHEMBL2483267

SCHEMBL2483267

COc1ccc2ccc(F)c(CC(O)[C@@H]3CC[C@@H](NCc4cc5c(cn4)OCS5)CO3)c2n1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.55
KCNH2 Q12809 1/20 0.54

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
SCHEMBL2483265 1.00 SLC2A1 (0.55) SLC2A1KCNH2
SCHEMBL2485629 0.94 KCNH2 (0.52) KCNH2
SCHEMBL2509566 0.92 SLC2A1 (0.66) SLC2A1KCNH2
SCHEMBL2505146 0.92 SLC2A1 (0.66) SLC2A1KCNH2
SCHEMBL2500818 0.89 KCNH2 (0.57) KCNH2
SCHEMBL2503540 0.86 KCNH2 (0.56) SLC2A1KCNH2
SCHEMBL2508203 0.86 KCNH2 (0.62) SLC2A1KCNH2
SCHEMBL2482432 0.86 KCNH2 (0.62) SLC2A1KCNH2
SCHEMBL586207 0.82 KCNH2 (0.53) SLC2A1KCNH2
SCHEMBL586385 0.81 KCNH2 (0.65) SLC2A1KCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376497-A1 5-AMINO-2-(1-HYDROXY-ETHYL)-TETRAHYDROPYRAN DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2011-10-19 EP disclosed
WO-2010067332-A1 5-AMINO-2-(1-HYDROXY-ETHYL)-TETRAHYDROPYRAN DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2010-06-17 WO disclosed