SCHEMBL29952340

SCHEMBL29952340

OB(O)c1cccc(COC2CCOC2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 6/20 0.44
LPL P06858 2/20 0.38
LIPG Q9Y5X9 2/20 0.38
EPHX1 P07099 1/20 0.37
PDE4D Q08499 4/20 0.35
PDE4A P27815 3/20 0.35
PDE4B Q07343 3/20 0.35
PDE4C Q08493 3/20 0.35
CTSL P07711 1/20 0.35
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
PRMT8 Q9NR22 1/20 0.34
DCPS Q96C86 1/20 0.33
NAAA Q02083 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
SLC6A4 P31645 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 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
SCHEMBL29954386 0.92 ENPP2 (0.46) ENPP2LPLLIPGEPHX1CARM1
SCHEMBL28445371 0.83 ENPP2 (0.40) ENPP2PDE4DPDE4APDE4BPDE4C
SCHEMBL21266517 0.83 ENPP2 (0.40) ENPP2PDE4DPDE4APDE4BPDE4C
SCHEMBL29958158 0.83 LPL (0.37) ENPP2LPLLIPGPDE4DPDE4A
SCHEMBL29953866 0.81 ENPP2 (0.50) ENPP2LPLLIPGEPHX1CARM1
SCHEMBL29952628 0.80 ENPP2 (0.49) ENPP2LPLLIPGEPHX1CARM1
SCHEMBL22305511 0.79 SLC6A2 (0.35) PDE4DPDE4APDE4BPDE4CCTSL
SCHEMBL22779206 0.79 CARM1 (0.36) PDE4DPDE4APDE4BPDE4CCTSL
SCHEMBL22290331 0.79 CARM1 (0.50) CARM1PRMT6
SCHEMBL31173262 0.79 CARM1 (0.50) CARM1PRMT6

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed