SCHEMBL6533356

SCHEMBL6533356

CCC(CO)(CO)[N+](=O)[O-].CCC(CO)(CO)[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
TSHR P16473 3/20 0.36
ALDH1A1 P00352 3/20 0.33
TDP1 Q9NUW8 2/20 0.32

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
SCHEMBL635431 1.00 LMNA (0.44) LMNATSHRALDH1A1TDP1
Nitric Acid SCHEMBL10949137 0.95 LMNA (0.41) LMNATSHRALDH1A1
SCHEMBL1117414 0.95 LMNA (0.44) LMNATSHRALDH1A1TDP1
Propionic Acid SCHEMBL6895209 0.89 FFAR3 (0.42) LMNAALDH1A1TDP1
SCHEMBL1117343 0.88 LMNA (0.39) LMNATSHRALDH1A1
Alcohol SCHEMBL27715966 0.86 LMNA (0.46) LMNATSHRALDH1A1TDP1
SCHEMBL27375341 0.83 LMNA (0.48) LMNATSHRALDH1A1TDP1
SCHEMBL22312 0.83 LMNA (0.52) LMNATSHRALDH1A1TDP1
SCHEMBL28652710 0.83 LMNA (0.52) LMNATSHRALDH1A1TDP1
SCHEMBL1117376 0.83 ALDH1A1 (0.37) LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1560486-A2 DECONTAMINATING SYSTEMS CONTAINING REACTIVE NANOPARTICLES AND BIOCIDES Nanoscale Materials, Inc. (US) 2005-08-10 EP claimed
US-6827766-B2 Decontaminating systems containing reactive nanoparticles and biocides UNITED STATES AIR FORCE 2004-12-07 US claimed
WO-2004032624-A2 DECONTAMINATING SYSTEMS CONTAINING REACTIVE NANOPARTICLES AND BIOCIDES NANOSCALE MATERIALS, INC. (US) 2004-04-22 WO claimed
US-20040067159-A1 Decontaminating systems containing reactive nanoparticles and biocides TIMILON CORPORATION 2004-04-08 US claimed