SCHEMBL2561344

SCHEMBL2561344

COc1cc(OC2CCN(C(=O)OC(C)(C)C)CC2)ccc1B(O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 6/20 0.55
PDE4B Q07343 3/20 0.55
PDE4A P27815 2/20 0.55
PDE4C Q08493 2/20 0.55
PDE4D Q08499 2/20 0.55
STS P08842 2/20 0.52
ALDH1A1 P00352 1/20 0.51
HRH3 Q9Y5N1 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CACNB4 O00305 1/20 0.47
CACNA1A O00555 1/20 0.47
CACNA1G O43497 1/20 0.47
CACNG3 O60359 1/20 0.47
CACNA1F O60840 1/20 0.47
CACNA1H O95180 1/20 0.47
CACNB3 P54284 1/20 0.47
CACNA2D1 P54289 1/20 0.47
CACNG7 P62955 1/20 0.47
CACNA1B Q00975 1/20 0.47

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
SCHEMBL29964523 0.86 GPR119 (0.55) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL1291501 0.86 GPR119 (0.57) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL18310133 0.85 GPR119 (0.54) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL7355186 0.85 GPR119 (0.54) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL30606457 0.84 GPR119 (0.53) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL7357692 0.84 GPR119 (0.53) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL7358039 0.84 GPR119 (0.53) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL12533230 0.83 GPR119 (0.67) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL7359420 0.83 GPR119 (0.54) GPR119PDE4BPDE4APDE4CPDE4D
SCHEMBL2825514 0.83 GPR119 (0.53) GPR119PDE4BPDE4APDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed