SCHEMBL5014067

SCHEMBL5014067

CC(C)CCCCCc1ccc(OP(Oc2ccc(CCCCCC(C)C)cc2CCCCCC(C)C)Oc2ccc(CCCCCC(C)C)cc2CCCCCC(C)C)c(CCCCCC(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.40
MAPT P10636 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPK1 P28482 2/20 0.40
RAD52 P43351 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
FUT7 Q11130 1/20 0.40
APAF1 O14727 2/20 0.38
THRB P10828 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
NPC1 O15118 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 2/20 0.34
BLM P54132 2/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL7949634 0.88 GRIN2D (0.36) HTTMAPTMEN1KMT2AMAPK1
SCHEMBL9650711 0.84 STAT3 (0.38)
SCHEMBL21986292 0.83 HTT (0.54) HTTMAPTMEN1KMT2AMAPK1
SCHEMBL1100395 0.83 HTT (0.54) HTTMAPTMEN1KMT2AMAPK1
SCHEMBL5014490 0.81 FUT7 (0.44) MEN1KMT2ANPSR1FUT7GRIN2D
SCHEMBL10937045 0.80 ADRB2 (0.43) THRB
SCHEMBL29366175 0.79 HTT (0.50) HTTMAPTMEN1KMT2AMAPK1
SCHEMBL125443 0.79 HTT (0.50) HTTMAPTMEN1KMT2AMAPK1
SCHEMBL3563040 0.77 HTT (0.49) HTTMAPTMEN1KMT2AMAPK1
SCHEMBL29532511 0.77 HTT (0.49) HTTMAPTMEN1KMT2AMAPK1

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-1947725-A2 Polymer electrolyte composition and fuel cell Sumitomo Chemical Company, Limited (JP) 2008-07-23 EP disclosed
EP-1289041-B1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL CO (JP) 2008-03-12 EP disclosed
US-20060257706-A1 POLYMER ELECTROLYTE COMPOSITION AND FUEL CELL HIDAKA YASUAKI 2006-11-16 US disclosed
US-20030113605-A1 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-06-19 US disclosed
EP-1289041-A2 Polymer electrolyte composition and fuel cell SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-05 EP disclosed