SCHEMBL7880368

SCHEMBL7880368

CC(C)(O)CC(C)(C)CCl

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
THRB P10828 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
SCHEMBL4318488 0.79 ALDH1A1 (0.47) ALDH1A1
SCHEMBL10063831 0.79
SCHEMBL12516732 0.77 ALDH1A1 (0.40) ALDH1A1
SCHEMBL168273 0.75
SCHEMBL9344793 0.73
SCHEMBL1975714 0.71
SCHEMBL38006 0.71
SCHEMBL3403440 0.71 ALDH1A1 (0.39) ALDH1A1
SCHEMBL1066136 0.71 ALDH1A1 (0.39) ALDH1A1
SCHEMBL2762967 0.71 ALDH1A1 (0.39) ALDH1A1

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
WO-2010107384-A1 ASPARTYL PROTEASE INHIBITORS MEDIVIR AB (SE) 2010-09-23 WO disclosed