SCHEMBL15329488

SCHEMBL15329488

CC(C)(C)OC(=O)N1CCC(c2cccc(B(O)O)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.51
THRB P10828 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MAPT P10636 1/20 0.50
GPR119 Q8TDV5 4/20 0.49
STS P08842 2/20 0.47
PDE4B Q07343 1/20 0.47
HTT P42858 1/20 0.46
TP53 P04637 1/20 0.46
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
ALOX12 P18054 1/20 0.45
GAA P10253 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44

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
SCHEMBL15330053 0.93 PDE4B (0.55) NAMPTTHRBKDM4EMAPTGPR119
SCHEMBL15330319 0.88 RORC (0.45) NAMPTKDM4EMAPTGPR119STS
SCHEMBL15330057 0.87 PDE4B (0.49) MAPTPDE4BTP53ALDH1A1
SCHEMBL21523778 0.85 TP53 (0.56) NAMPTTHRBKDM4EMAPTGPR119
SCHEMBL12419663 0.85 NAMPT (0.58) NAMPTTHRBKDM4EMAPTGPR119
SCHEMBL1558412 0.84 NAMPT (0.54) NAMPTTHRBKDM4EMAPTGPR119
SCHEMBL30563607 0.84 GPR119 (0.65) NAMPTTHRBKDM4EMAPTGPR119
SCHEMBL30673157 0.84 NAMPT (0.54) NAMPTTHRBKDM4EMAPTGPR119
SCHEMBL15043876 0.82 NAMPT (0.53) NAMPTTHRBKDM4EMAPTGPR119
SCHEMBL1427529 0.82 NAMPT (0.53) NAMPTTHRBKDM4EMAPTGPR119

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 5 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