SCHEMBL5528368

SCHEMBL5528368

CCOC(=O)C(F)(F)[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 4/20 0.37
ALDH1A1 P00352 3/20 0.37
PKM P14618 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP4F2 P78329 2/20 0.35
CYP4A11 Q02928 2/20 0.35
THRB P10828 1/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAPT P10636 2/20 0.35
RAB9A P51151 1/20 0.35
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34

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
SCHEMBL7620521 0.83 FBP1 (0.38) FBP1ALDH1A1PKMKDM4EMEN1
SCHEMBL9778618 0.79 PKM (0.37) FBP1ALDH1A1PKMKDM4EMEN1
SCHEMBL17674102 0.78 ALDH1A1 (0.40) FBP1ALDH1A1PKMKDM4EMEN1
SCHEMBL11804056 0.77 FBP1 (0.44) FBP1ALDH1A1PKMKDM4EMEN1
SCHEMBL8412595 0.77 FBP1 (0.41) FBP1ALDH1A1PKMKDM4EMEN1
SCHEMBL23829928 0.76 CYP2C19 (0.40) ALDH1A1POLBNPSR1MAPTRAB9A
SCHEMBL8398253 0.75 FBP1 (0.40) FBP1ALDH1A1PKMKDM4EMEN1
SCHEMBL28272742 0.75 CYP4F2 (0.39) FBP1ALDH1A1PKMKDM4EMEN1
SCHEMBL11803604 0.73 FBP1 (0.39) FBP1ALDH1A1PKMKDM4EMEN1
SCHEMBL8400791 0.73 PKM (0.43) FBP1ALDH1A1PKMKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1854160-A2 REDOX-ACTIVE STRUCTURES AND DEVICES UTILIZING THE SAME YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2007-11-14 EP claimed
WO-2006085319-A2 REDOX-ACTIVE STRUCTURES AND DEVICES UTILIZING THE SAME YEDA RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 2006-08-17 WO claimed
US-20220290962-A1 SYSTEMS AND METHODS FOR SIMULATING BLAST EFFECTS OF AN EXPLOSIVE LAYER 3 SERVICES PTY LTD (AU) 2022-09-15 US disclosed
WO-2022153314-A1 A PROCESS FOR BLASTING TAMAR ISRAELI ADVANCED QUARRYING CO. LTD (IL) 2022-07-21 WO disclosed
EP-3228624-A2 REDOX-ACTIVE CHROMOPHORE MOLECULES AND DEVICES UTILIZING THE SAME YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2017-10-11 EP disclosed
EP-1854160-A2 REDOX-ACTIVE STRUCTURES AND DEVICES UTILIZING THE SAME YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2007-11-14 EP disclosed
WO-2006085319-A2 REDOX-ACTIVE STRUCTURES AND DEVICES UTILIZING THE SAME YEDA RESEARCH AND DEVELOPMENT COMPANY LTD. (IL) 2006-08-17 WO disclosed