SCHEMBL28044916

SCHEMBL28044916

O=C(O)C(O)CCCS(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.48
FFAR1 O14842 1/20 0.48
TET2 Q6N021 6/20 0.44
KDM4A O75164 2/20 0.44
KDM4C Q9H3R0 2/20 0.44
KDM2A Q9Y2K7 2/20 0.44
TET3 O43151 2/20 0.44
APP P05067 1/20 0.41
OR51E2 Q9H255 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
TBXAS1 P24557 2/20 0.35
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
LMNA P02545 1/20 0.33
SLC6A6 P31641 1/20 0.33
CYP2C19 P33261 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.32
TET1 Q8NFU7 1/20 0.32

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
SCHEMBL6634667 0.83 APP (0.38) GPR84FFAR1APPPTGS1PDE4A
SCHEMBL3026588 0.81 APP (0.44) APPTBXAS1PTGS1PDE4ALMNA
SCHEMBL11231589 0.77 GPR84 (0.64) GPR84FFAR1TET2KDM4AKDM4C
SCHEMBL11651698 0.77 GPR84 (0.71) GPR84FFAR1TET2KDM4AKDM4C
SCHEMBL6632928 0.77 APP (0.37) GPR84FFAR1APPPTGS1PDE4A
SCHEMBL6633289 0.77 APP (0.37) GPR84FFAR1APPPTGS1PDE4A
SCHEMBL38660644 0.76 GSR (0.54) APPCYP2C19BLMPMP22
SCHEMBL1979848 0.75 APP (0.48) APPPTGS1PDE4ALMNASLC6A6
SCHEMBL8416077 0.75 APP (0.35) APP
SCHEMBL5696751 0.75 GPR84 (0.76) GPR84FFAR1TET2KDM4AKDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105296557-A Synthesis method of D, L-alpha-methionine calcium GAO DAYUAN 2016-02-03 CN claimed
CN-105296557-A Synthesis method of D, L-alpha-methionine calcium GAO DAYUAN 2016-02-03 CN disclosed
CN-105296557-A Synthesis method of D, L-alpha-methionine calcium GAO DAYUAN 2016-02-03 CN disclosed
CN-101854907-B Cosmetic composition comprising hydroxymethionine and 3-aminopropanesulfonic acid SEDERMA SA 2014-06-18 CN disclosed
CN-101854907-A Cosmetic composition comprising hydroxymethionine and 3-aminopropanesulfonic acid SEDERMA SA 2010-10-06 CN disclosed