SCHEMBL4196818

SCHEMBL4196818

O=C(C(=O)c1cc(C#Cc2ccccc2)cc(C(=O)C(=O)c2ccc(C#Cc3ccccc3)cc2)c1)c1ccc(C#Cc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.52
CES1 P23141 5/20 0.52
HNF4A P41235 1/20 0.47
FFAR1 O14842 4/20 0.47
APP P05067 1/20 0.46
GRM5 P41594 2/20 0.45
FFAR4 Q5NUL3 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP12 P39900 1/20 0.44
MMP14 P50281 1/20 0.44
MMP15 P51511 1/20 0.44
MMP16 P51512 1/20 0.44
MMP26 Q9NRE1 1/20 0.44
ASIC3 Q9UHC3 1/20 0.44
AKR1C2 P52895 1/20 0.44
AKR1C1 Q04828 1/20 0.44
VCP P55072 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
SCHEMBL4848452 0.90 CES2 (0.56) CES2CES1HNF4AFFAR1APP
SCHEMBL3753633 0.90 CES2 (0.64) CES2CES1HNF4AFFAR1APP
SCHEMBL13582217 0.90 FFAR1 (0.46) CES2CES1HNF4AFFAR1APP
SCHEMBL4190711 0.89 CES2 (0.58) CES2CES1HNF4AFFAR1APP
SCHEMBL6675223 0.88 CES2 (0.68) CES2CES1FFAR1APPGRM5
SCHEMBL5533189 0.87 FFAR1 (0.49) CES2CES1HNF4AFFAR1ASIC3
SCHEMBL2336741 0.86 CES2 (0.71) CES2CES1FFAR1APPGRM5
SCHEMBL2707734 0.82 APP (0.52) HNF4AFFAR1APPFFAR4AKR1C2
SCHEMBL6142583 0.81 CES2 (0.45) CES2CES1HNF4AFFAR1APP
SCHEMBL16103102 0.80 RARB (0.56) CES2CES1HNF4AFFAR1APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1476416-B1 MULTIFUNCTIONAL MONOMERS AND THEIR USE IN MAKING CROSS-LINKED POLYMERS AND POROUS FILMS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-12-30 EP disclosed
US-7635741-B2 Curable polyacetylenes used as dielectrics in making microelectronics such as integrated circuits DOW GLOBAL TECHNOLOGIES INC. 2009-12-22 US disclosed
EP-1476416-A2 MULTIFUNCTIONAL MONOMERS AND THEIR USE IN MAKING CROSS-LINKED POLYMERS AND POROUS FILMS DOW GLOBAL TECHNOLOGIES INC. (US) 2004-11-17 EP disclosed
US-20040053033-A1 Multifunctional monomers and their use in making cross-linked polymers and porous films NIU Q JASON (US) 2004-03-18 US disclosed
WO-2003068825-A2 MULTIFUNCTIONAL MONOMERS AND THEIR USE IN MAKING CROSS-LINKED POLYMERS AND POROUS FILMS DOW GLOBAL TECHNOLOGIES INC. (US) 2003-08-21 WO disclosed