SCHEMBL29619688

SCHEMBL29619688

OCCC(CCO)c1cc(F)c(F)cc1O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.38
ADRA2B P18089 2/20 0.38
ADRA2C P18825 2/20 0.38
ADRA1A P35348 2/20 0.38
ADRB2 P07550 2/20 0.38
CYP3A4 P08684 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
APEX1 P27695 1/20 0.37
RAD52 P43351 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ADRB1 P08588 1/20 0.33
ADRB3 P13945 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
SCHEMBL23213252 1.00 ADRA2A (0.38) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL23213368 0.78 MRGPRX4 (0.38)
SCHEMBL23213258 0.72 ADRA2A (0.36) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL18894040 0.70 ADRA2A (0.40) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL23434932 0.69 LMNA (0.48) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL22206862 0.68 ADRA2A (0.44) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL30446707 0.68 ADRA2A (0.44) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL2355498 0.67 ADRB2 (0.31) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL24775387 0.67 PDE2A (0.47) ADRA2AADRA2BADRA2CADRA1AADRB2
SCHEMBL23295193 0.66 MRGPRX4 (0.41) MAPTTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119390705-A 5-Oxa-2-azaspiro [3.4] octane derivatives as M4 agonists 诺华股份有限公司 2025-02-07 CN disclosed
CN-114555606-B 5-Oxa-2-azaspiro [3.4] octane derivatives as M4 agonists 诺华股份有限公司 2024-10-01 CN disclosed
CN-114555606-A 5-oxa-2-azaspiro [3.4] octane derivatives as M4 agonists 诺华股份有限公司 2022-05-27 CN disclosed