SCHEMBL5497973

SCHEMBL5497973

CCOC(OCC)(C(=O)O)C(C(=O)O)S(=O)(=O)O

nearest known ligand 0.30

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
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
SCHEMBL11034437 0.75 NAAA (0.37)
SCHEMBL3395723 0.73
SCHEMBL155620 0.71 CHRM1 (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL3989531 0.71 MEN1 (0.32)
SCHEMBL407626 0.68 THRB (0.31)
SCHEMBL9179913 0.68 CHRM1 (0.35) CHRM1AKR1A1CHRM3HTR2AHTR2C
SCHEMBL844661 0.67 ALDH1A1 (0.33)
SCHEMBL28565059 0.67 LMNA (0.33)
Ammonia Solution, Strong SCHEMBL845178 0.66 ALDH1A1 (0.32)
SCHEMBL7170251 0.66 CHRM1 (0.33) CHRM1AKR1A1CHRM3HTR2AHTR2C

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
EP-1771148-A1 MILD, MOISTURIZING SULFOSUCCINATE CLEANSING COMPOSITIONS Unilever Plc (GB) 2007-04-11 EP disclosed
WO-2006007925-A1 MILD, MOISTURIZING SULFOSUCCINATE CLEANSING COMPOSITIONS UNILEVER PLC (GB) 2006-01-26 WO disclosed