SCHEMBL3139537

SCHEMBL3139537

CCCCCON([C]=O)CCCC

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 9/20 0.33
CA2 P00918 9/20 0.33
CA9 Q16790 8/20 0.33
LPAR3 Q9UBY5 3/20 0.32
CA12 O43570 3/20 0.32
CA7 P43166 3/20 0.32
CA14 Q9ULX7 3/20 0.32
LPAR1 Q92633 2/20 0.32
LPAR2 Q9HBW0 2/20 0.32
CA3 P07451 2/20 0.32
CA4 P22748 2/20 0.32
CA6 P23280 2/20 0.32
CA5A P35218 2/20 0.32
CA5B Q9Y2D0 2/20 0.32
NAAA Q02083 1/20 0.32
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RECQL P46063 2/20 0.31
CES2 O00748 1/20 0.31
GLA P06280 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
SCHEMBL7296925 0.96 DNM1 (0.34) CA1CA2CA9LPAR3CA12
SCHEMBL7452131 0.90 CA1 (0.35) CA1CA2CA9LPAR3CA12
SCHEMBL6131279 0.90 CA1 (0.35) CA1CA2CA9LPAR3CA12
SCHEMBL10483577 0.90 CA1 (0.35) CA1CA2CA9LPAR3CA12
SCHEMBL9322043 0.85 CYP3A4 (0.33) CA1CA2
SCHEMBL3558594 0.76
SCHEMBL3569323 0.74 DNM1 (0.37) CA1CA2CA9CA12TSHR
SCHEMBL8997122 0.72 CA1 (0.38) CA1CA2CA9LPAR3CA12
SCHEMBL1936019 0.72 TSHR (0.33) TSHR
SCHEMBL2079805 0.69

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-1816173-B1 Manufacturing method of nonaqueous pigment dispersion liquid, and ink composition, ink jet recording composition, image forming method and recorded material using the same FUJIFILM CORP (JP) 2010-07-21 EP disclosed
EP-1770134-B1 Photochemically curable ink composition comprising an alkylated oxirane FUJIFILM CORP (JP) 2009-11-11 EP disclosed
EP-1816173-A1 Manufacturing method of nonaqueous pigment dispersion liquid, and ink composition, ink jet recording composition, image forming method and recorded material using the same FUJIFILM Corporation (JP) 2007-08-08 EP disclosed
EP-1772498-A2 Ink composition, and imageforming method and recorded material using the same FUJIFILM Corporation (JP) 2007-04-11 EP disclosed
EP-1770134-A1 Photochemically curable ink composition comprising an alkylated oxirane FUJIFILM Corporation (JP) 2007-04-04 EP disclosed