SCHEMBL6233200

SCHEMBL6233200

CCOC(=O)[C@@H](N)CSC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.38
ALDH1A1 P00352 5/20 0.37
CYP2D6 P10635 2/20 0.37
METAP2 P50579 4/20 0.36
METAP1 P53582 4/20 0.36
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 2/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NOD1 Q9Y239 2/20 0.34
GAA P10253 2/20 0.34
PIN1 Q13526 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33

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
SCHEMBL4727588 0.84 ALDH1A1 (0.39) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL11739657 0.81 ALOX15 (0.42) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL110807 0.81 ALOX15 (0.42) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL6304330 0.81 METAP2 (0.45) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL12655937 0.81 ALOX15 (0.42) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL12438531 0.81 ALOX15 (0.42) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL110806 0.81 ALOX15 (0.42) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL112490 0.81 ALOX15 (0.42) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL12707509 0.81 ALOX15 (0.42) ALOX15ALDH1A1CYP2D6METAP2METAP1
SCHEMBL110808 0.81 ALOX15 (0.42) ALOX15ALDH1A1CYP2D6METAP2METAP1

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 8 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-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-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