SCHEMBL18022129

SCHEMBL18022129

CC(C)(C)OC(=O)CN1CCN(CC(=O)ON2C(=O)CCC2=O)CCN(CC(O)OC(C)(C)C)CCN(CC(=O)OC(C)(C)C)CC1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 1/20 0.34
▸ PLA2G5 P39877 1/20 0.34
▸ CNR1 P21554 1/20 0.30
▸ CHRM2 P08172 1/20 0.30
▸ CHRM4 P08173 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ CHRM3 P20309 1/20 0.30

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
SCHEMBL3700587 0.89 PLA2G10 (0.38) PLA2G10PLA2G5CNR1CHRM2CHRM4
SCHEMBL19422321 0.88 VEGFA (0.35) —
SCHEMBL30069168 0.84 PLA2G10 (0.35) PLA2G10PLA2G5CNR1CHRM2CHRM4
SCHEMBL9925280 0.83 PLA2G10 (0.34) PLA2G10PLA2G5CNR1CHRM2CHRM4
SCHEMBL3690735 0.83 PLA2G10 (0.37) PLA2G10PLA2G5CNR1CHRM2CHRM4
SCHEMBL18752979 0.81 PLA2G10 (0.34) PLA2G10PLA2G5CHRM2CHRM4CHRM1
SCHEMBL19431539 0.80 PLA2G10 (0.36) PLA2G10PLA2G5CHRM2CHRM4CHRM1
SCHEMBL19422330 0.79 SIGMAR1 (0.40) PLA2G10PLA2G5CNR1CHRM2CHRM4
SCHEMBL22403178 0.79 SIGMAR1 (0.40) PLA2G10PLA2G5CNR1CHRM2CHRM4
SCHEMBL19274145 0.79 SIGMAR1 (0.40) PLA2G10PLA2G5CNR1CHRM2CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160237208-A1 Multifunctional Degradable Nanoparticles with Control over Size and Functionalities UNIV VANDERBILT (US) 2016-08-18 — — US disclosed
US-20160237208-A1 Multifunctional Degradable Nanoparticles with Control over Size and Functionalities UNIV VANDERBILT (US) 2016-08-18 — — US disclosed
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