SCHEMBL13336563

SCHEMBL13336563

C=C(C)CCCCCCCOC(=O)C(C)(C)Br

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.40
POLB P06746 2/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALDH1A1 P00352 4/20 0.33
CYP3A4 P08684 1/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
NAAA Q02083 1/20 0.32
DGKA P23743 1/20 0.32
GAA P10253 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
EPHX1 P07099 2/20 0.30
FAAH O00519 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL13010132 0.93 TSHR (0.34) TSHRPOLBALDH1A1GAANPSR1
SCHEMBL13336573 0.92 TSHR (0.37) TSHRPOLBAPEX1HTTTDP1
SCHEMBL13336578 0.92 TSHR (0.37) TSHRPOLBAPEX1HTTTDP1
SCHEMBL21986664 0.86 TSHR (0.38) TSHRPOLBAPEX1HTTTDP1
SCHEMBL28902649 0.85 NAAA (0.40) TSHRPOLBTDP1ALDH1A1CYP3A4
SCHEMBL651971 0.85 NAAA (0.40) TSHRPOLBTDP1ALDH1A1CYP3A4
SCHEMBL37083 0.83 POLB (0.39) TSHRPOLBTDP1ALDH1A1CYP3A4
SCHEMBL12623917 0.83 TSHR (0.61) TSHRPOLBAPEX1HTTTDP1
SCHEMBL13528759 0.83 TSHR (0.61) TSHRPOLBAPEX1HTTTDP1
SCHEMBL14447081 0.82 DGKA (0.50) TSHRTDP1ALDH1A1CYP3A4PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8551676-B2 Pigment-dispersed composition, curable composition, and color filter and production method thereof FUJIFILM CORPORATION (JP) 2013-10-08 US disclosed
US-20100119959-A1 PIGMENT-DISPERSED COMPOSITION, CURABLE COMPOSITION, AND COLOR FILTER AND PRODUCTION METHOD THEREOF FUJIFILM CORPORATION (JP) 2010-05-13 US disclosed
US-7569328-B2 Resin composition and thermo/photosensitive composition FUJIFILM CORPORATION (JP) 2009-08-04 US disclosed