SCHEMBL1668277

SCHEMBL1668277

CC(=O)C(C)O.CC1OC(C)(O)C(C)OC1(C)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TP53 P04637 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
SCHEMBL1669130 0.78
SCHEMBL11472240 0.72
SCHEMBL73997 0.69
SCHEMBL42054 0.69
SCHEMBL28280814 0.69 TP53 (0.57) TP53
SCHEMBL74607 0.69
SCHEMBL901230 0.69 TP53 (0.57) TP53
Ammonia Solution, Strong SCHEMBL6545802 0.66
Charcoal, Activated SCHEMBL12487647 0.66
Isopropyl Alcohol SCHEMBL16321076 0.66 TP53 (0.53) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2485678-A1 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2012-08-15 EP disclosed
WO-2011043817-A1 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2011-04-14 WO disclosed