SCHEMBL16745705

SCHEMBL16745705

CC(C(=O)O)C(OC(O)C(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP13 P45452 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
SCHEMBL16744179 0.78 TP53 (0.35) TP53SLC1A3SLC1A2SLC1A1MMP1
SCHEMBL9346677 0.74 TP53 (0.47) TP53SLC1A3SLC1A2SLC1A1MMP1
SCHEMBL17813056 0.74
SCHEMBL9504659 0.73 TSHR (0.44) TP53
SCHEMBL17010828 0.72 SLC1A3 (0.54) TP53SLC1A3SLC1A2SLC1A1MMP1
SCHEMBL17010830 0.71 SMN1; SMN2 (0.36) SLC1A3SLC1A2SLC1A1MMP1MMP2
SCHEMBL16249745 0.70 TP53 (0.36) TP53SLC1A3SLC1A2SLC1A1MMP1
SCHEMBL12951567 0.67 TP53 (0.60) TP53
SCHEMBL812149 0.66 TP53 (0.57) TP53
SCHEMBL812166 0.66 TP53 (0.57) TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150147558-A1 OXIDIZED CELLULOSE-BASED MATERIAL, METHOD FOR OBTAINING SAME AND USE THEREOF AS COMPRESS SYMATESE (FR) 2015-05-28 US disclosed