SCHEMBL1684993

SCHEMBL1684993

CCCCCCOCC=C(C)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.52
LSS P48449 1/20 0.46
EP300 Q09472 1/20 0.43
HCAR2 Q8TDS4 2/20 0.42
THRB P10828 2/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 1/20 0.41
PLA2G2C Q5R387 4/20 0.41
TSHR P16473 2/20 0.41
NAAA Q02083 1/20 0.40
LCK P06239 1/20 0.39
PPARD Q03181 1/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
EPHX1 P07099 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PGGT1B P53609 1/20 0.38

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
SCHEMBL213672 0.93 ALDH1A1 (0.42) CES2LSSEP300HCAR2TSHR
SCHEMBL6553353 0.85 HCAR2 (0.35) CES2LSSEP300HCAR2TSHR
SCHEMBL5386604 0.84 CES2 (0.50) CES2EP300HCAR2THRBMEN1
SCHEMBL5399497 0.84 CES2 (0.50) CES2EP300HCAR2THRBMEN1
SCHEMBL5382943 0.84 CES2 (0.50) CES2EP300HCAR2THRBMEN1
SCHEMBL25222990 0.84 CES2 (0.50) CES2EP300HCAR2THRBMEN1
SCHEMBL7092774 0.84 CES2 (0.50) CES2EP300HCAR2THRBMEN1
SCHEMBL7776375 0.84 CES2 (0.50) CES2LSSHCAR2THRBMEN1
SCHEMBL5830404 0.82 CES2 (0.47) CES2EP300HCAR2THRBMEN1
SCHEMBL22972971 0.81 EP300 (0.50) CES2EP300THRBMEN1HTT

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-2303940-A1 BLOCK COPOLYMERS ON THE BASIS OF (METH) ACRYLATE Henkel AG & Co. KGaA (DE) 2011-04-06 EP disclosed
WO-2010009911-A1 BLOCK COPOLYMERS ON THE BASIS OF (METH) ACRYLATE HENKEL AG & CO. KGAA (DE) 2010-01-28 WO disclosed