SCHEMBL13901151

SCHEMBL13901151

O=C(CCCC(=O)OCc1ccccc1)NCCCNCCCCNCCCNC(=O)CCCC(=O)OCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
TSHR P16473 1/20 0.55
EPHX2 P34913 1/20 0.52
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
HDAC3 O15379 5/20 0.49
HDAC4 P56524 5/20 0.49
HDAC1 Q13547 5/20 0.49
HDAC2 Q92769 5/20 0.49
HDAC10 Q969S8 5/20 0.49
HDAC11 Q96DB2 5/20 0.49
HDAC8 Q9BY41 5/20 0.49
HDAC6 Q9UBN7 5/20 0.49
HDAC9 Q9UKV0 5/20 0.49
HDAC7 Q8WUI4 4/20 0.49
HDAC5 Q9UQL6 4/20 0.49
NCOR2 Q9Y618 2/20 0.49
GAA P10253 1/20 0.49
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48

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
SCHEMBL17767811 0.90 EPHX2 (0.61) LMNATSHREPHX2HTTL3MBTL1
SCHEMBL17767806 0.90 EPHX2 (0.61) LMNATSHREPHX2HTTL3MBTL1
SCHEMBL26315834 0.88 LMNA (0.64) LMNATSHREPHX2HTTL3MBTL1
SCHEMBL18743946 0.86 HPGD (0.58) LMNATSHREPHX2HTTL3MBTL1
SCHEMBL13901153 0.86 HTT (0.44) LMNATSHREPHX2HTTL3MBTL1
SCHEMBL24414987 0.86 HPGD (0.61) LMNATSHREPHX2L3MBTL1HPGD
SCHEMBL20334484 0.85 HDAC3 (0.50) LMNATSHREPHX2HTTL3MBTL1
SCHEMBL17589268 0.85 HPGD (0.52) LMNATSHREPHX2HTTL3MBTL1
SCHEMBL17599911 0.84 EPHX2 (0.56) LMNATSHREPHX2HTTL3MBTL1
SCHEMBL18703881 0.84 EPHX2 (0.56) LMNATSHREPHX2HTTL3MBTL1

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-7507859-B2 Functional synthetic molecules and macromolecules for gene delivery FIFTH BASE LLC (US) 2009-03-24 US disclosed