SCHEMBL13664640

SCHEMBL13664640

C=C(F)C(=O)OCOc1ccc(CCC(=O)Oc2ccc(OC(=O)CCc3ccc(OCOC(=O)C(=C)F)cc3)c(C(F)(F)F)c2C(F)(F)F)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.35
FFAR4 Q5NUL3 4/20 0.35
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
AKR1C3 P42330 2/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PPARD Q03181 1/20 0.32
FAAH O00519 1/20 0.32
SYK P43405 1/20 0.32

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
SCHEMBL12110790 0.84 THRB (0.40) FFAR1FFAR4ADRB2ADRB1AKR1C3
SCHEMBL13664629 0.84 MAOB (0.34) KMT2APPARD
SCHEMBL13664635 0.81 MAOB (0.33) KMT2APPARD
SCHEMBL14185457 0.79 THRB (0.39) FFAR1FFAR4ADRB2ADRB1AKR1C3
SCHEMBL12567643 0.78 THRB (0.39) FFAR1FFAR4ADRB2ADRB1AKR1C3
SCHEMBL14588364 0.76 THRB (0.44) FFAR1AKR1C3KMT2ALMNAL3MBTL1
SCHEMBL13289692 0.76 MAPT (0.36) FFAR1FFAR4ADRB2ADRB1LMNA
SCHEMBL14088407 0.75 THRB (0.43) FFAR1AKR1C3
SCHEMBL14679493 0.75 AKR1C3 (0.44) FFAR1AKR1C3KMT2ALMNA
SCHEMBL14063178 0.74 TP53 (0.41) FFAR1FFAR4KMT2ALMNA

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
US-7597945-B2 Optical compensation film; mixture of three (meth)acrylate monomers: e.g. 2,7-bis(acryloyloxyhexyloxy-1,4-phenylenecarbonyloxy)fluorene, a bis 2-fluoroacrylate monomer, and a cyanobiphenyloxyalkanol ester of (meth)acrylic acid; hardness, heat resistance, weatherability, colorless, LC physical properties CHISSO CORPORATION (JP) 2009-10-06 US disclosed
US-7597945-B2 Optical compensation film; mixture of three (meth)acrylate monomers: e.g. 2,7-bis(acryloyloxyhexyloxy-1,4-phenylenecarbonyloxy)fluorene, a bis 2-fluoroacrylate monomer, and a cyanobiphenyloxyalkanol ester of (meth)acrylic acid; hardness, heat resistance, weatherability, colorless, LC physical properties CHISSO CORPORATION (JP) 2009-10-06 US disclosed