SCHEMBL11064258

SCHEMBL11064258

CC(=O)CC(=O)OCCC1(C)OCCO1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGAM O43451 2/20 0.39
GAA P10253 2/20 0.39
SI P14410 2/20 0.39
MGAM2 Q2M2H8 2/20 0.39

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
SCHEMBL11064174 0.81 MGAM (0.41) MGAMGAASIMGAM2
SCHEMBL31191925 0.81 ALDH1A1 (0.40) GAA
SCHEMBL27774725 0.81 DGKA (0.39)
Butane SCHEMBL10711300 0.74 FAAH (0.36)
SCHEMBL1835849 0.74 MGLL (0.36)
SCHEMBL11598383 0.73 FAAH (0.38)
SCHEMBL2701579 0.73 GAA (0.60) MGAMGAASIMGAM2
SCHEMBL7847493 0.72 TSHR (0.46) MGAMGAASIMGAM2
SCHEMBL6022632 0.71 MGAM (0.43) MGAMGAASIMGAM2
SCHEMBL11064461 0.71

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-4446325-A VASODILATION, HYPOTENSIVE AGENTS MARUKO SEIYAKU CO., LTD. (JP) 1984-05-01 US disclosed