SCHEMBL3375169

SCHEMBL3375169

CCCCCOCCC(O)CO

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.66
PLA2G2C Q5R387 1/20 0.53
HTT P42858 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
THRB P10828 1/20 0.52
MAPT P10636 1/20 0.52
TSHR P16473 1/20 0.46
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42
LPAR5 Q9H1C0 1/20 0.42
LMNA P02545 2/20 0.41
SPHK1 Q9NYA1 2/20 0.41
KDM4E B2RXH2 1/20 0.41
DUSP3 P51452 1/20 0.41
CES2 O00748 1/20 0.39

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
SCHEMBL8585380 0.98 USP2 (0.69) USP2PLA2G2CHTTMEN1KMT2A
SCHEMBL10406329 0.98 USP2 (0.69) USP2PLA2G2CHTTMEN1KMT2A
SCHEMBL11890619 0.94 USP2 (0.57) USP2PLA2G2CHTTMEN1KMT2A
SCHEMBL28189988 0.90 USP2 (0.69) USP2PLA2G2CHTTMEN1KMT2A
SCHEMBL28165908 0.90 USP2 (0.69) USP2PLA2G2CHTTMEN1KMT2A
SCHEMBL27280251 0.90 USP2 (0.69) USP2PLA2G2CHTTMEN1KMT2A
SCHEMBL16218012 0.90 USP2 (0.69) USP2PLA2G2CHTTMEN1KMT2A
Glycerin SCHEMBL2420770 0.89 USP2 (0.73) USP2PLA2G2CHTTMEN1KMT2A
SCHEMBL21122156 0.89 USP2 (0.62) USP2PLA2G2CHTTMEN1KMT2A
SCHEMBL20055683 0.88 USP2 (0.56) USP2PLA2G2CHTTMEN1KMT2A

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
EP-2184367-A1 Non-hydrolytic microbial probes Biosynth AG (CH) 2010-05-12 EP disclosed
WO-2010049450-A1 Non-hydrolytic microbial probes BIOSYNTH AG (CH) 2010-05-06 WO disclosed