SCHEMBL13664633

SCHEMBL13664633

C=C(F)C(=O)OCOc1ccc(COc2ccc(-c3ccc(OCc4ccc(OCOC(=O)C(=C)F)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.47
PARP10 Q53GL7 2/20 0.44
NR4A2 P43354 2/20 0.43
PTPRC P08575 1/20 0.43
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
MAOB P27338 4/20 0.42
GSTP1 P09211 1/20 0.42
MMP12 P39900 1/20 0.41
MCL1 Q07820 1/20 0.41
RXRA P19793 3/20 0.40
RXRB P28702 3/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40

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
SCHEMBL13664637 0.82 PPARD (0.44) FFAR1PARP10MAOBFFAR4
SCHEMBL20053205 0.75 NPC1 (0.50) FFAR1NPC1RAB9ASMN1; SMN2
SCHEMBL21266378 0.75 APP (0.40) POLB
SCHEMBL16541362 0.74 POLB (0.51) NPC1POLBRAB9ASMN1; SMN2
SCHEMBL12172629 0.74 POLB (0.51) NPC1POLBRAB9ASMN1; SMN2
SCHEMBL13664634 0.73 KMT2A (0.42) PARP10NPC1POLBSMN1; SMN2
SCHEMBL22596477 0.73 MAOB (0.49) FFAR1PARP10PTPRCPTPN2PTPN1
SCHEMBL22596640 0.73 MAOB (0.49) FFAR1PARP10PTPRCPTPN2PTPN1
SCHEMBL26362251 0.73 MAOB (0.49) FFAR1PARP10PTPRCPTPN2PTPN1
SCHEMBL16707082 0.72 MAOB (0.42) FFAR1NR4A2PTPRCPTPN2PTPN1

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