SCHEMBL756679

SCHEMBL756679

CCCCC(CCC)C(C(=O)O)C(C(=O)O)(C(CCC)CCCC)S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.33
MAPK1 P28482 1/20 0.33
CHRM1 P11229 1/20 0.30
AKR1A1 P14550 1/20 0.30
CHRM3 P20309 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
ADRA1A P35348 1/20 0.30
HRH1 P35367 1/20 0.30
DRD3 P35462 1/20 0.30
SLC6A3 Q01959 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL7100300 0.91 CHRM1 (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL7955205 0.91 CHRM1 (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C
Ammonia Solution, Strong SCHEMBL7101844 0.91 CHRM1 (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C
Ammonia Solution, Strong SCHEMBL7101848 0.91 CHRM1 (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C
Trolamine SCHEMBL7094955 0.83
SCHEMBL2045547 0.82 GPR84 (0.35) CA2MAPK1
SCHEMBL8674327 0.81 CA2 (0.36) CA2
SCHEMBL1244942 0.81 GPR84 (0.34) CA2MAPK1
Ammonia Solution, Strong SCHEMBL7098909 0.80 GPR84 (0.36)
SCHEMBL7100637 0.80 GPR84 (0.36)

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
EP-1984467-B1 BARRIER SLURRY COMPOSITIONS AND BARRIER CMP METHODS FREESCALE SEMICONDUCTOR INC (US) 2012-03-21 EP disclosed
EP-1984467-A2 BARRIER SLURRY COMPOSITIONS AND BARRIER CMP METHODS Freescale Semiconductor, Inc. (US) 2008-10-29 EP disclosed
WO-2007102138-A3 BARRIER SLURRY COMPOSITIONS AND BARRIER CMP METHODS FREESCALE SEMICONDUCTOR INC (US) 2007-12-13 WO disclosed
WO-2007102138-A2 BARRIER SLURRY COMPOSITIONS AND BARRIER CMP METHODS FREESCALE SEMICONDUCTOR, INC. (US) 2007-09-13 WO disclosed