SCHEMBL13784262

SCHEMBL13784262

CCCCCCCCCCCCCCC(I)CO

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
CYP2D6 P10635 2/20 0.48
SPHK1 Q9NYA1 2/20 0.48
MAPT P10636 2/20 0.48
GMNN O75496 1/20 0.48
POLB P06746 1/20 0.48
THPO P40225 1/20 0.48
MTOR P42345 1/20 0.48
BLM P54132 1/20 0.48
KDM4E B2RXH2 1/20 0.48
TP53 P04637 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CETP P11597 1/20 0.48
HTT P42858 1/20 0.48
UBE2N P61088 1/20 0.48
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 1/20 0.43

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
SCHEMBL8587785 1.00 LMNA (0.58) LMNACYP2D6SPHK1MAPTGMNN
SCHEMBL11410274 1.00 LMNA (0.58) LMNACYP2D6SPHK1MAPTGMNN
SCHEMBL9887965 0.97
SCHEMBL29197320 0.90
SCHEMBL18461275 0.88 LMNA (0.47) LMNACYP2D6SPHK1MAPTGMNN
SCHEMBL18324135 0.84 TSHR (0.50) LMNASPHK1MAPTTSHRGPR84
SCHEMBL2507860 0.84 TSHR (0.50) LMNASPHK1MAPTTSHRGPR84
SCHEMBL17879364 0.84 TSHR (0.50) LMNASPHK1MAPTTSHRGPR84
SCHEMBL21436918 0.84 TSHR (0.50) LMNASPHK1MAPTTSHRGPR84
SCHEMBL1333027 0.84 TSHR (0.50) LMNASPHK1MAPTTSHRGPR84

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
WO-2009086547-A1 ANTIOXIDANT NANOSPHERE COMPRISING [1,2]-DITHIOLANE MOIETIES CEDARS-SINAI MEDICAL CENTER (US) 2009-07-09 WO disclosed