SCHEMBL13638247

SCHEMBL13638247

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nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
TDP1 Q9NUW8 2/20 0.56
KDM4E B2RXH2 2/20 0.46
PDE4A P27815 1/20 0.40
TSHR P16473 2/20 0.39
USP2 O75604 1/20 0.37
SLCO1B1 Q9Y6L6 1/20 0.37
TOP1 P11387 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TRPA1 O75762 1/20 0.31

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
SCHEMBL11923038 1.00 LMNA (0.59) LMNAL3MBTL1TDP1KDM4EPDE4A
SCHEMBL10461156 1.00 LMNA (0.59) LMNAL3MBTL1TDP1KDM4EPDE4A
SCHEMBL6058989 1.00 LMNA (0.59) LMNAL3MBTL1TDP1KDM4EPDE4A
SCHEMBL8609071 0.91 LMNA (0.65) LMNAL3MBTL1TDP1KDM4EPDE4A
SCHEMBL19000301 0.91 LMNA (0.65) LMNAL3MBTL1TDP1KDM4EPDE4A
SCHEMBL12552441 0.91 LMNA (0.65) LMNAL3MBTL1TDP1KDM4EPDE4A
SCHEMBL16605707 0.91 LMNA (0.65) LMNAL3MBTL1TDP1KDM4EPDE4A
SCHEMBL12240960 0.88 TDP1 (0.67) LMNAL3MBTL1TDP1KDM4EPDE4A
SCHEMBL16074668 0.83 TDP1 (0.53) LMNAL3MBTL1TDP1KDM4ETSHR
SCHEMBL14346962 0.83 TDP1 (0.53) LMNAL3MBTL1TDP1KDM4ETSHR

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
EP-1689789-B1 NOVEL CYCLODEXTRIN DIMERS AND DERIVATIVES THEREOF, METHODS FOR PREPARING THEM AND THEIR USE, IN PARTICULAR, FOR SOLUBILIZING PHARMACOLOGICALLY ACTIVE SUBSTANCES CENTRE NAT RECH SCIENT (FR) 2009-11-11 EP disclosed