SCHEMBL28044844

SCHEMBL28044844

CC(C(=O)O)N(C)C.C[NH+](C)[O-]

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
CA1 P00915 1/20 0.33
SLC7A5 Q01650 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
Acetic Acid SCHEMBL28815459 0.90 CA1 (0.47) TP53CA1
SCHEMBL14889907 0.89 TP53 (0.44) TP53SLC7A5
SCHEMBL27445506 0.89 TP53 (0.44) TP53SLC7A5
SCHEMBL50988 0.89
SCHEMBL50989 0.89
SCHEMBL754117 0.89
Water SCHEMBL439514 0.86
Hydrochloric Acid SCHEMBL1007680 0.86
Water SCHEMBL439515 0.86
SCHEMBL22164139 0.86

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
CN-105505370-A Clean fracturing fluid and preparation method thereof CHINA PETROLEUM & CHEM CORP 2016-04-20 CN disclosed