SCHEMBL719850

SCHEMBL719850

O=C1CCCC(=O)N1c1cccc2cc3ccccc3cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.41
DDAH1 O94760 1/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 0.40
GAA P10253 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 2/20 0.38
GSR P00390 1/20 0.37
APEX1 P27695 1/20 0.37
CASP6 P55212 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ELANE P08246 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36

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
SCHEMBL718741 0.84 POLB (0.58) POLBDDAH1KMT2AMEN1GAA
SCHEMBL27555104 0.81 SCN9A (0.47) KMT2AMEN1GAAALDH1A1MAPT
SCHEMBL719837 0.77 TLR9 (0.57) POLBGAAALDH1A1MAPTPKM
SCHEMBL31387987 0.77 TLR9 (0.57) POLBGAAALDH1A1MAPTPKM
SCHEMBL890402 0.77 POLB (0.61) POLBDDAH1KMT2AMEN1GAA
SCHEMBL719069 0.76 TLR9 (0.55) POLBGAAALDH1A1MAPTPKM
SCHEMBL723971 0.76 TLR9 (0.55) POLBGAAALDH1A1MAPTPKM
SCHEMBL28171508 0.74 ALDH1A1 (0.47) POLBDDAH1KMT2AMEN1GAA
SCHEMBL28282376 0.73 HTR1A (0.44) KMT2AGAAALDH1A1HPGDHSD17B10
SCHEMBL718047 0.73 ALDH1A1 (0.43) POLBDDAH1KMT2AGAAALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9150414-B2 Nanocomposite and dispersion comprising the same KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2015-10-06 US disclosed
US-20120053288-A1 NANOCOMPOSITE AND DISPERSION COMPRISING THE SAME KABUSHIKI KAISHA TOYOTA CHUO KENKYUSHO (JP) 2012-03-01 US disclosed