SCHEMBL809863

SCHEMBL809863

C=Cc1ccc(Cl)cc1CCC(C)Cl

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.31
S1PR1 P21453 1/20 0.31
KDM4E B2RXH2 1/20 0.31
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
SLC6A3 Q01959 2/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
DRD2 P14416 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
ADRA1D P25100 1/20 0.31
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
HTR2C P28335 1/20 0.31
HTR1E P28566 1/20 0.31
HTR7 P34969 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
ADRA1B P35368 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
SCHEMBL809517 0.86 S1PR1 (0.31) S1PR1KDM4ETDP1MEN1SLC22A1
SCHEMBL810449 0.84 SRC (0.34) HTR2ASLC6A4SLC6A3HTR1AADRA2A
SCHEMBL809892 0.80 KDM4E (0.30) KDM4E
SCHEMBL809944 0.80 HTR2A (0.38) HTR2ASLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL809443 0.78 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3
SCHEMBL28564772 0.78 SLC6A2 (0.35) HTR2AS1PR1KDM4ESLC6A2SLC6A4
SCHEMBL15524757 0.75 HPGD (0.36) HTR2ASLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL8170934 0.75 TDP1 (0.41) KDM4ESLC6A2SLC6A4TDP1MEN1
SCHEMBL809722 0.75 PTGDR (0.35) HTR2AKDM4ESLC6A2SLC6A4SLC6A3
SCHEMBL809975 0.73 TDP1 (0.32) TDP1MEN1SLC22A1USP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012015977-A3 HIGHLY PORTABLE AND STABLE WORK STATION HERSCHLER MATTHEW B (US) 2012-05-10 WO disclosed
EP-2192645-B1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORP (JP) 2011-11-30 EP disclosed
US-20110250525-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME TOKUYAMA CORPORATION (JP) 2011-10-13 US disclosed
EP-2192645-A1 SEPARATION MEMBRANE FOR DIRECT LIQUID FUEL CELL AND METHOD FOR PRODUCING THE SAME Tokuyama Corporation (JP) 2010-06-02 EP disclosed