SCHEMBL29470976

SCHEMBL29470976

CCCOC(=O)C1(C)CCN(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 8/20 0.41
SLC22A1 O15245 1/20 0.41
SLC6A4 P31645 1/20 0.41
ADRA1A P35348 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
KCNH2 Q12809 1/20 0.41
SCN1A P35498 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
ALDH1A1 P00352 1/20 0.34
BDKRB2 P30411 1/20 0.34
TLR2 O60603 1/20 0.34

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
SCHEMBL29470957 0.90 OPRM1 (0.36) OPRM1SLC22A1SLC6A4ADRA1AOPRD1
SCHEMBL2607180 0.85 OPRM1 (0.54) OPRM1SLC22A1SLC6A4ADRA1AOPRD1
Iodide SCHEMBL30309825 0.84 OPRM1 (0.53) OPRM1SLC22A1SLC6A4ADRA1AOPRD1
SCHEMBL17286018 0.81 SMN1; SMN2 (0.50) OPRM1SLC22A1SLC6A4ADRA1AOPRD1
SCHEMBL1439148 0.81 ALDH1A1 (0.38) SLC22A1KCNH2SCN1ASCN2ASCN3A
SCHEMBL1439277 0.79 CYP3A4 (0.40) KCNH2SCN1ASCN2ASCN3ACHRM5
SCHEMBL17284634 0.78 ALDH1A1 (0.50) ALDH1A1
SCHEMBL24763400 0.77 OPRM1 (0.37) OPRM1SLC22A1SLC6A4ADRA1AOPRD1
SCHEMBL12881565 0.77 POLB (0.37) CHRM1ALDH1A1
SCHEMBL18819444 0.75 ALDH1A1 (0.38) KCNH2CHRM1ALDH1A1

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
CN-114127044-A Ionizable amine lipids and lipid nanoparticles 英特利亚治疗股份有限公司 2022-03-01 CN disclosed