SCHEMBL8716545

SCHEMBL8716545

CCOC(C)OC(=O)COc1cc[c]cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
POLB P06746 1/20 0.40
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PLA2G4B P0C869 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
PPARA Q07869 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL10434788 0.85 GAA (0.43) MAPTPOLBNPSR1GAAPLA2G4B
SCHEMBL10434758 0.84 MAPT (0.46) MAPTPOLBNPSR1GAASMN1; SMN2
SCHEMBL10434827 0.82 MAPT (0.44) MAPTPOLBGAASMN1; SMN2ALDH1A1
SCHEMBL10435025 0.80 MAPT (0.43) MAPTPOLBNPSR1GAASMN1; SMN2
SCHEMBL8905603 0.80 MAPT (0.46) MAPTALDH1A1PPARA
SCHEMBL8372907 0.80 MAPT (0.46) MAPTPOLBNPSR1GAASMN1; SMN2
SCHEMBL9627341 0.79 MAPT (0.45) MAPTPOLBNPSR1GAASMN1; SMN2
SCHEMBL1444267 0.78 GAA (0.61) MAPTPOLBNPSR1GAASMN1; SMN2
SCHEMBL10738675 0.75 L3MBTL1 (0.41) MAPTPOLBNPSR1GAAALDH1A1
SCHEMBL23295 0.74 PTGS2 (0.53) MAPTPOLBGAASMN1; SMN2ALDH1A1

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-5780206-A USING AN ANTHRACENE DERIVATIVE AS AN ABSORBER ON HIGHLY REFLECTIVE SURFACES; ALKALI-SOLUBLE POLYMERS; GENERATION OF ACID CATALYSTS; FINE PATTERNS WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1998-07-14 US disclosed