SCHEMBL7879927

SCHEMBL7879927

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

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 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
SCHEMBL3183247 0.98 TP53 (0.38) TP53ALDH1A1TSHR
SCHEMBL4410669 0.86 TP53 (0.43) TP53ALDH1A1TSHR
SCHEMBL30977948 0.86 TP53 (0.43) TP53ALDH1A1TSHR
SCHEMBL29867947 0.86 TP53 (0.43) TP53ALDH1A1TSHR
SCHEMBL27931388 0.84 TP53 (0.41) TP53ALDH1A1TSHR
SCHEMBL28052627 0.84 TP53 (0.41) TP53ALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL5697791 0.84 TP53 (0.41) TP53ALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL27462516 0.82 TP53 (0.39) TP53ALDH1A1TSHR
Water SCHEMBL2573978 0.82 TP53 (0.39) TP53ALDH1A1TSHR
SCHEMBL5016403 0.76 MMP8 (0.41) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6326042-B1 REDUCING CONTAMINATION FOOD (FRUITS,VEGETABLES,CARCASSES) BY MIXING TWO TO TEN MOLECULES PER COMPLEX; SAFETY THE CURATORS OF THE UNIVERSITY OF MISSOURI 2001-12-04 US disclosed
WO-2000065924-A1 ANTIMICROBIAL USE OF HEAT-TREATED LACTIC AND/OR GLYCOLIC ACID COMPOSITIONS FOR TREATMENT OF GROUND MEATS THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2000-11-09 WO disclosed
US-5900266-A OLIGOMERIZATION THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 1999-05-04 US disclosed