SCHEMBL491733

SCHEMBL491733

C=CC(=O)N(CCP(=O)(OCC)OCC)CCP(=O)(OCC)OCC

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.46
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 1/20 0.37
ZDHHC20 Q5W0Z9 2/20 0.36
ZDHHC2 Q9UIJ5 1/20 0.36
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPT P10636 1/20 0.31
HTT P42858 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
SCHEMBL3345155 0.92 ZDHHC20 (0.44) PPARDTSHRTDP1ZDHHC20ZDHHC2
SCHEMBL14488577 0.79 PPARD (0.42) PPARDTSHRTDP1
SCHEMBL491525 0.76 PPARD (0.50) PPARDTSHRTDP1MEN1GAA
Acrylic Acid SCHEMBL27785060 0.73 PPARD (0.50) PPARDTSHRTDP1MAPTHTT
SCHEMBL15032677 0.72 ZDHHC20 (0.41) TSHRTDP1ZDHHC20ZDHHC2MAPT
SCHEMBL13624819 0.71 PPARD (0.58) PPARDTSHRTDP1MEN1GAA
SCHEMBL3343066 0.71 ZDHHC20 (0.49) TSHRZDHHC20ZDHHC2
SCHEMBL36287 0.71 ZDHHC20 (0.50) TSHRTDP1ZDHHC20ZDHHC2
SCHEMBL16281581 0.71 ZDHHC20 (0.51) TSHRZDHHC20ZDHHC2MEN1KMT2A
SCHEMBL978404 0.70 TSHR (0.52) PPARDTSHR

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8105689-B2 Adhesive, coating or film composition applied to a surface BASF SE (DE) 2012-01-31 US disclosed
US-8105689-B2 Adhesive, coating or film composition applied to a surface BASF SE (DE) 2012-01-31 US disclosed
US-8105689-B2 Adhesive, coating or film composition applied to a surface BASF SE (DE) 2012-01-31 US disclosed
EP-1902078-B1 (METH)ACRYLAMIDE PHOSPHORUS MONOMER COMPOSITION BASF SE (DE) 2011-06-22 EP disclosed
EP-1902078-A1 (METH)ACRYLAMIDE PHOSPHORUS MONOMER COMPOSITION Ciba Specialty Chemicals Holding, Inc. (CH) 2008-03-26 EP disclosed
US-20070028805-A1 (Meth)acrylamide phosphorus monomer compositions BASF SE (DE) 2007-02-08 US disclosed
US-20070028805-A1 (Meth)acrylamide phosphorus monomer compositions BASF SE (DE) 2007-02-08 US disclosed
US-20070028805-A1 (Meth)acrylamide phosphorus monomer compositions BASF SE (DE) 2007-02-08 US disclosed
WO-2007006648-A1 (METH)ACRYLAMIDE PHOSPHORUS MONOMER COMPOSITION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-01-18 WO disclosed
WO-2007006648-A1 (METH)ACRYLAMIDE PHOSPHORUS MONOMER COMPOSITION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-01-18 WO disclosed