SCHEMBL14747652

SCHEMBL14747652

CCCCOC[C@@H](O)[C@@H](CO)OCCCC

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.55
SPHK1 Q9NYA1 1/20 0.49
MGAM O43451 3/20 0.45
HTT P42858 2/20 0.44
TSHR P16473 1/20 0.42
LPAR1 Q92633 4/20 0.41
LPAR3 Q9UBY5 4/20 0.41
LPAR2 Q9HBW0 1/20 0.41
PLA2G2C Q5R387 1/20 0.39
LPAR5 Q9H1C0 1/20 0.39
MEN1 O00255 1/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37

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
SCHEMBL10990567 1.00 USP2 (0.55) USP2SPHK1MGAMHTTTSHR
SCHEMBL11415242 0.96 USP2 (0.61) USP2SPHK1MGAMHTTLPAR1
SCHEMBL1818619 0.95 USP2 (0.53) USP2SPHK1MGAMHTTTSHR
SCHEMBL29169777 0.95 USP2 (0.62) USP2SPHK1MGAMHTTLPAR1
SCHEMBL29169752 0.95 USP2 (0.62) USP2SPHK1MGAMHTTLPAR1
SCHEMBL5189905 0.91 USP2 (0.44) USP2SPHK1MGAMHTTTSHR
SCHEMBL5189900 0.91 USP2 (0.53) USP2SPHK1MGAMHTTTSHR
SCHEMBL16510046 0.89 SPHK1 (0.51) USP2SPHK1HTTTSHRLPAR1
SCHEMBL13314273 0.89 SPHK1 (0.51) USP2SPHK1HTTTSHRLPAR1
SCHEMBL14747646 0.88 USP2 (0.46) USP2SPHK1MGAMHTTTSHR

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-8389565-B2 Antidiabetic agents; controlling carbohydrate metabolism SIMON FRASER UNIVERSITY (CA) 2013-03-05 US disclosed