SCHEMBL10079239

SCHEMBL10079239

C=COCNC1CC(C)(C)NC(C)(C)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.43
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
ALDH1A1 P00352 4/20 0.39
NPSR1 Q6W5P4 1/20 0.39
RECQL P46063 2/20 0.36
KMT2A Q03164 3/20 0.33
SLC2A1 P11166 1/20 0.33
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
PKM P14618 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
RAD52 P43351 1/20 0.32
GFER P55789 1/20 0.32
KDM1A O60341 1/20 0.31
POLB P06746 2/20 0.31
USP2 O75604 1/20 0.31
ATM Q13315 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
SCHEMBL10079242 0.77 GAA (0.40) GAAKDM4ELMNAALDH1A1NPSR1
SCHEMBL736625 0.76 GAA (0.58) GAAKDM4ELMNAALDH1A1NPSR1
SCHEMBL11652673 0.72 GAA (0.47) GAAKDM4ELMNAALDH1A1NPSR1
SCHEMBL8434608 0.72 GAA (0.50) GAAKDM4ELMNAALDH1A1NPSR1
SCHEMBL13632282 0.72 GAA (0.42) GAAKDM4ELMNAALDH1A1NPSR1
SCHEMBL15533499 0.70 SLC2A1 (0.43) GAAKDM4ELMNAALDH1A1NPSR1
SCHEMBL8433236 0.70 GAA (0.49) GAAKDM4ELMNAALDH1A1NPSR1
SCHEMBL11290082 0.69 GAA (0.45) GAAKDM4ELMNAALDH1A1NPSR1
Ammonia Solution, Strong SCHEMBL16678784 0.69 SLC2A1 (0.42) GAAKDM4ELMNAALDH1A1NPSR1
SCHEMBL8432690 0.69 SLC2A1 (0.50) GAAKDM4ELMNAALDH1A1NPSR1

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-8158212-B2 Ink composition, inkjet recording method, and printed material FUJIFILM CORPORATION (JP) 2012-04-17 US disclosed
US-20080286484-A1 INK COMPOSITION, INKJET RECORDING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2008-11-20 US disclosed