SCHEMBL30143525

SCHEMBL30143525

CCCCCCCCC(C)(OC(CCCCCCCC)(CCCCCCCC)C(=O)O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.38
TSHR P16473 5/20 0.37
TP53 P04637 1/20 0.37
GPR84 Q9NQS5 7/20 0.36
PPARG P37231 6/20 0.36
PPARD Q03181 6/20 0.36
PPARA Q07869 6/20 0.36
HDAC11 Q96DB2 5/20 0.36
ALDH1A1 P00352 2/20 0.36
TLR2 O60603 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
FABP4 P15090 2/20 0.36
PTPN1 P18031 2/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
SLC22A8 Q8TCC7 1/20 0.36
MEN1 O00255 1/20 0.36
ESR1 P03372 1/20 0.36
ALOX15 P16050 1/20 0.36
PDE4A P27815 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL3280834 0.89 CES2 (0.42) CES2TSHRGPR84PPARGPPARD
SCHEMBL3285281 0.89 CES2 (0.42) CES2TSHRGPR84PPARGPPARD
SCHEMBL9423044 0.81 ALDH1A1 (0.38) TSHRTP53GPR84PPARGPPARD
SCHEMBL165416 0.78 MEN1 (0.40) CES2TSHRGPR84PPARGPPARD
SCHEMBL9335557 0.78 MEN1 (0.40) CES2TSHRGPR84PPARGPPARD
SCHEMBL3294522 0.78 MEN1 (0.40) CES2TSHRGPR84PPARGPPARD
SCHEMBL28265919 0.78 CES2 (0.40) CES2TSHRGPR84PPARGPPARD
SCHEMBL28960879 0.76 CES2 (0.39) CES2TSHRGPR84PPARGPPARD
SCHEMBL28497128 0.76 GAA (0.48) CES2TSHRGPR84PPARGPPARD
SCHEMBL14142393 0.76 GAA (0.48) CES2TSHRGPR84PPARGPPARD

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
CN-115504901-B [A336] method for preparing nuclear-grade zirconium and nuclear-grade hafnium by extracting and separating [ DGA ] type ionic liquid in acidic system 厦门稀土材料研究所 2024-08-09 CN disclosed
CN-115504901-A [A336] Method for preparing nuclear grade zirconium and nuclear grade hafnium by extracting and separating [ DGA ] type ionic liquid in acid system 厦门稀土材料研究所 2022-12-23 CN disclosed