SCHEMBL709324

SCHEMBL709324

CCCCn1ccc(C)c1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 7/20 0.37
DRD3 P35462 7/20 0.37
DRD1 P21728 6/20 0.37
DRD4 P21917 6/20 0.37
DRD5 P21918 6/20 0.37
LMNA P02545 2/20 0.36
HTT P42858 2/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CNR2 P34972 1/20 0.32
GRIN2B Q13224 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTR1D P28221 2/20 0.31
HTR1A P08908 1/20 0.31
HTR1B P28222 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
SCHEMBL1039551 0.74 GRM2 (0.42) DRD2DRD3DRD1DRD4DRD5
SCHEMBL2830180 0.72 ALDH1A1 (0.46) DRD2DRD3DRD1DRD4DRD5
SCHEMBL19164856 0.68 ALDH1A1 (0.48) LMNAHTTTSHRALDH1A1POLB
SCHEMBL17247459 0.66 KDM4E (0.38) DRD2DRD3DRD1DRD4DRD5
SCHEMBL14763652 0.65 ALDH1A1 (0.33) DRD2DRD3LMNAHTTTSHR
SCHEMBL2829918 0.64 CA2 (0.49) DRD2DRD3DRD1DRD4DRD5
SCHEMBL1056478 0.64 HTR1D (0.47) DRD2DRD3DRD1DRD4DRD5
SCHEMBL12776580 0.63 DRD2 (0.41) DRD2DRD3DRD1DRD4DRD5
SCHEMBL20048158 0.63 PPARA (0.42) DRD2DRD3DRD1DRD4DRD5
SCHEMBL17247572 0.63 HTR2C (0.37) DRD2DRD3DRD1DRD4DRD5

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-8124785-B2 Method for producing nanoparticles NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2012-02-28 US disclosed
US-20090306394-A1 Method for Producing Nanoparticles NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2009-12-10 US disclosed