SCHEMBL5016010

SCHEMBL5016010

CCCCCCCCN(CCCCCCCC)CCCCCCCC.O=S(=O)(NS(=O)(=O)C(F)(F)F)C(F)(F)F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.55
KDM5A P29375 2/20 0.38
PHF8 Q9UPP1 2/20 0.38
MCHR1 Q99705 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
FAAH O00519 5/20 0.36
CACNA1F O60840 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
CHRM3 P20309 1/20 0.36
HTR2A P28223 1/20 0.36
SLC6A4 P31645 1/20 0.36
DRD3 P35462 1/20 0.36
CACNA1D Q01668 1/20 0.36
KCNH2 Q12809 1/20 0.36
CACNA1S Q13698 1/20 0.36
CACNA1C Q13936 1/20 0.36
ICMT O60725 1/20 0.36
ALB P02768 1/20 0.36

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
SCHEMBL30646140 1.00 EPHX1 (0.55) EPHX1KDM5APHF8MCHR1KDM4C
SCHEMBL29702539 1.00 EPHX1 (0.55) EPHX1KDM5APHF8MCHR1KDM4C
SCHEMBL29615765 0.92 EPHX1 (0.48) EPHX1KDM5APHF8MCHR1KDM4C
Dodecane SCHEMBL30193423 0.88 EPHX1 (0.67) EPHX1FAAHCES1CES2
Nonane SCHEMBL30193525 0.88 EPHX1 (0.67) EPHX1FAAHCES1CES2
SCHEMBL6143177 0.86 EPHX1 (0.51) EPHX1KDM5APHF8MCHR1KDM4C
SCHEMBL29687148 0.84 EPHX1 (0.42) EPHX1KDM5APHF8KDM4C
SCHEMBL24247669 0.82 EPHX1 (0.51) EPHX1FAAHDNM1CES1CES2
SCHEMBL30557872 0.82 EPHX1 (0.47) EPHX1KDM5APHF8KDM4CDNM1
Pentane SCHEMBL29587231 0.82 EPHX1 (0.57) EPHX1FAAHCES1CES2

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-2022117942-A1 MIXTURES OF QUATERNARY AMMONIUM SALTS FOR EXTRACTING URANIUM(VI) FROM AQUEOUS SOLUTIONS OF SULFURIC ACID COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2022-06-09 WO claimed
WO-2022117942-A1 MIXTURES OF QUATERNARY AMMONIUM SALTS FOR EXTRACTING URANIUM(VI) FROM AQUEOUS SOLUTIONS OF SULFURIC ACID COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2022-06-09 WO disclosed
EP-1991632-A1 HEAT RESERVOIR AND METHOD FOR PROCESSING A SUBSTRATE COUPLED TO A HEAT RESERVOIR Q-Cells AG (DE) 2008-11-19 EP disclosed
WO-2008095873-A1 HEAT RESERVOIR AND METHOD FOR PROCESSING A SUBSTRATE COUPLED TO A HEAT RESERVOIR Q-CELLS SE (DE) 2008-08-14 WO disclosed