SCHEMBL11079148

SCHEMBL11079148

CC(C)(O)C=O.CCOC(C)OCC

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
THRB P10828 1/20 0.32
PGD P52209 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
SCHEMBL4808596 0.81 LMNA (0.48) LMNA
SCHEMBL8831182 0.81 LMNA (0.48) LMNA
Formic Acid SCHEMBL6366884 0.80 LMNA (0.67) LMNATHRB
SCHEMBL9295759 0.80 LMNA (0.67) LMNATHRBPGD
SCHEMBL6887705 0.79 LMNA (0.57) LMNATHRB
SCHEMBL11341801 0.79 LMNA (0.57) LMNATHRB
Acetaldehyde SCHEMBL212729 0.78 LMNA (0.71) LMNATHRB
SCHEMBL4293299 0.78 LMNA (0.71) LMNATHRB
SCHEMBL20656759 0.77 LMNA (0.43) LMNA
SCHEMBL5582150 0.76 LMNA (0.60) LMNATHRB

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-4469887-A MULTISTAGE CHEMISCHE WERKE HUELS, AG (DE) 1984-09-04 US disclosed