SCHEMBL9013529

SCHEMBL9013529

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

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.34
GLA P06280 1/20 0.34
TSHR P16473 2/20 0.33
CTH P32929 1/20 0.33
CBS P35520 1/20 0.33
THPO P40225 1/20 0.33
FFAR3 O14843 1/20 0.33
THRB P10828 1/20 0.32
MAPT P10636 1/20 0.32
PAM P19021 2/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL7367474 0.88 ALDH1A1 (0.36) TSHRFFAR3THRBCYP2D6CYP2C19
SCHEMBL19025405 0.77 LMNA (0.35)
SCHEMBL2162997 0.76 ALDH1A1 (0.32) TSHRFFAR3
SCHEMBL223597 0.76 ALDH1A1 (0.32) FFAR3
SCHEMBL11427415 0.76 GLA (0.33) L3MBTL1GLATSHRCTHCBS
SCHEMBL13544525 0.74 GLA (0.35) L3MBTL1GLATSHRCTHCBS
SCHEMBL19025369 0.74 ALDH1A1 (0.40) L3MBTL1TSHR
SCHEMBL3947831 0.71 TSHR (0.37) L3MBTL1GLATSHRCTHCBS
SCHEMBL28427067 0.70 FFAR3 (0.35) L3MBTL1GLATSHRCTHCBS
SCHEMBL10268363 0.70 FFAR3 (0.35) L3MBTL1GLATSHRCTHCBS

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
JP-8244339-A None JP disclosed
JP-H08244339-A PRESSURE-RESISTANT RECORDING DEVELOPER COMPOSITION AND PRESSURE-RESISTANT RECORDING SHEET MITSUI TOATSU CHEM INC 1996-09-24 JP disclosed