SCHEMBL26413494

SCHEMBL26413494

CCC(C)OC(=O)CC(CO)C(N)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
PRKCA P17252 1/20 0.33
CA12 O43570 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32
CA13 Q8N1Q1 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
LMNA P02545 2/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL19821802 0.81 CA1 (0.41) CA1CA2PRKCACA12CA3
SCHEMBL19821889 0.79 PRKCA (0.32) CA1CA2PRKCACA12CA3
SCHEMBL20921907 0.78 PRKCA (0.35) CA1CA2PRKCACA12CA3
SCHEMBL19821810 0.77 PRKCA (0.37) CA1CA2PRKCACA12CA3
SCHEMBL19821942 0.77 PRKCA (0.30) PRKCAEPHX2
SCHEMBL15478217 0.76 LMNA (0.36) CA1CA2PRKCACA12CA3
SCHEMBL18431389 0.75 MMP1 (0.35) CA1CA2PRKCACA12CA3
SCHEMBL14887224 0.75 CA12 (0.35) CA1CA2CA12CA3CA4
SCHEMBL2692319 0.74 MMP1 (0.52) CA1CA2PRKCACA12CA3
SCHEMBL2980554 0.74 MMP1 (0.52) CA1CA2PRKCACA12CA3

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-20230129965-A1 HYDROPHILIC AND OLEOPHOBIC POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2023-04-27 US disclosed