SCHEMBL6231973

SCHEMBL6231973

CCCC(SC[C@H](N)C(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 5/20 0.48
GRIK2 Q13002 5/20 0.48
SLC1A2 P43004 5/20 0.48
SLC1A1 P43005 5/20 0.48
SLC1A3 P43003 4/20 0.48
KIF11 P52732 4/20 0.40
CHRM1 P11229 1/20 0.40
AKR1A1 P14550 1/20 0.40
CHRM3 P20309 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
ADRA1A P35348 1/20 0.40
HRH1 P35367 1/20 0.40
DRD3 P35462 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ARG1 P05089 1/20 0.38
ARG2 P78540 1/20 0.38

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
SCHEMBL4323276 0.83 BHMT (0.47) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL29365585 0.82 GSR (0.45) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL4169490 0.81 GRM8 (0.57) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL22689615 0.77 CHRM1 (0.48) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL30368430 0.77 GRIK1 (0.44) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL5484085 0.77 GRIK1 (0.44) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL3235556 0.77 GRIK1 (0.44) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL3235567 0.77 GRIK1 (0.44) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL1478672 0.76 CPB1 (0.49) GRIK1GRIK2SLC1A2SLC1A1SLC1A3
SCHEMBL20362608 0.76 CPB1 (0.49) GRIK1GRIK2SLC1A2SLC1A1SLC1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1282397-B1 USE OF COMPOUNDS CONTAINING A THIO-ETHER, SULPHOXIDE OR SULPHONE FUNCTION AS COSMETIC ANTI-POLLUTION AGENT OREAL (FR) 2005-05-04 EP claimed
EP-0858319-B1 USE OF CARBOXYLIC ACIDS HAVING A SULPHUR FUNCTION FOR PROMOTING SKIN EXFOLIATION OR STIMULATING EPIDERMAL REGENERATION OREAL (FR) 2003-07-23 EP claimed
EP-1282397-A1 USE OF COMPOUNDS CONTAINING A THIO-ETHER, SULPHOXIDE OR SULPHONE FUNCTION AS COSMETIC ANTI-POLLUTION AGENT L'OREAL (FR) 2003-02-12 EP claimed
WO-2001087261-A1 USE OF COMPOUNDS CONTAINING A THIO-ETHER, SULPHOXIDE OR SULPHONE FUNCTION AS COSMETIC ANTI-POLLUTION AGENT L'OREAL (FR) 2001-11-22 WO claimed
EP-0858319-A1 USE OF CARBOXYLIC ACIDS HAVING A SULPHUR FUNCTION FOR PROMOTING SKIN EXFOLIATION OR STIMULATING EPIDERMAL REGENERATION L'OREAL (FR) 1998-08-19 EP claimed
WO-1997016165-A1 USE OF CARBOXYLIC ACIDS HAVING A SULPHUR FUNCTION FOR PROMOTING SKIN EXFOLIATION OR STIMULATING EPIDERMAL REGENERATION L'OREAL (FR) 1997-05-09 WO claimed
EP-1282397-B1 USE OF COMPOUNDS CONTAINING A THIO-ETHER, SULPHOXIDE OR SULPHONE FUNCTION AS COSMETIC ANTI-POLLUTION AGENT OREAL (FR) 2005-05-04 EP disclosed
EP-0858319-B1 USE OF CARBOXYLIC ACIDS HAVING A SULPHUR FUNCTION FOR PROMOTING SKIN EXFOLIATION OR STIMULATING EPIDERMAL REGENERATION OREAL (FR) 2003-07-23 EP disclosed
EP-1282397-A1 USE OF COMPOUNDS CONTAINING A THIO-ETHER, SULPHOXIDE OR SULPHONE FUNCTION AS COSMETIC ANTI-POLLUTION AGENT L'OREAL (FR) 2003-02-12 EP disclosed
WO-2001087261-A1 USE OF COMPOUNDS CONTAINING A THIO-ETHER, SULPHOXIDE OR SULPHONE FUNCTION AS COSMETIC ANTI-POLLUTION AGENT L'OREAL (FR) 2001-11-22 WO disclosed
EP-0858319-A1 USE OF CARBOXYLIC ACIDS HAVING A SULPHUR FUNCTION FOR PROMOTING SKIN EXFOLIATION OR STIMULATING EPIDERMAL REGENERATION L'OREAL (FR) 1998-08-19 EP disclosed
WO-1997016165-A1 USE OF CARBOXYLIC ACIDS HAVING A SULPHUR FUNCTION FOR PROMOTING SKIN EXFOLIATION OR STIMULATING EPIDERMAL REGENERATION L'OREAL (FR) 1997-05-09 WO disclosed