SCHEMBL244875

SCHEMBL244875

CCC(CC)(CC)P(=O)(O)O.Cc1cc(C)cc(C)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 5/20 0.45
PGK2 P07205 5/20 0.45
ALDH1A1 P00352 2/20 0.37
TSHR P16473 2/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TPMT P51580 1/20 0.34
FDPS P14324 3/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.33
SRC P12931 1/20 0.33
PTPN5 P54829 1/20 0.33

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
SCHEMBL246809 0.83 FDPS (0.43) FDPSLMNA
Phosphoric Acid SCHEMBL29023595 0.74 PGK1 (0.52) PGK1PGK2ALDH1A1TSHRCYP3A4
Phosphoric Acid SCHEMBL15475844 0.74 PGK1 (0.52) PGK1PGK2ALDH1A1TSHRCYP3A4
Phosphoric Acid SCHEMBL31047197 0.72 PGK1 (0.50) PGK1PGK2ALDH1A1TSHRCYP3A4
SCHEMBL7263779 0.71 FDPS (0.58) TSHRFDPS
SCHEMBL28077666 0.71 PGK1 (0.40) PGK1PGK2TSHRLMNASRC
SCHEMBL6835461 0.70 FDPS (0.39) FDPSLMNA
SCHEMBL5051559 0.70 PGK1 (0.39) PGK1PGK2
SCHEMBL6896476 0.69 FDPS (0.54) FDPS
SCHEMBL11168978 0.69 FDPS (0.54) FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2545583-B1 METHODS AND COMPOSITIONS FOR DOPING SILICON SUBSTRATES WITH MOLECULAR MONOLAYERS VERSUM MAT US LLC (US) 2020-05-13 EP disclosed
US-8906774-B2 Methods and compositions for doping silicon substrates with molecular monolayers DYNALOY, LLC (US) 2014-12-09 US disclosed
US-8835290-B2 Methods and compositions for doping silicon substrates with molecular monolayers DYNALOY, LLC (US) 2014-09-16 US disclosed
US-20130260545-A1 METHODS AND COMPOSITIONS FOR DOPING SILICON SUBSTRATES WITH MOLECULAR MONOLAYERS DYNALOY, LLC (US) 2013-10-03 US disclosed
US-8466035-B2 Methods and compositions for doping silicon substrates with molecular monolayers DYNALOY, LLC (US) 2013-06-18 US disclosed
US-20130059433-A1 METHODS AND COMPOSITIONS FOR DOPING SILICON SUBSTRATES WITH MOLECULAR MONOLAYERS DYNALOY, LLC (US) 2013-03-07 US disclosed
EP-2545583-A1 METHODS AND COMPOSITIONS FOR DOPING SILICON SUBSTRATES WITH MOLECULAR MONOLAYERS Dynaloy, LLC (US) 2013-01-16 EP disclosed
US-20120003826-A1 METHODS AND COMPOSITIONS FOR DOPING SILICON SUBSTRATES WITH MOLECULAR MONOLAYERS VERSUM MATERIALS US, LLC 2012-01-05 US disclosed
WO-2011112546-A1 METHODS AND COMPOSITIONS FOR DOPING SILICON SUBSTRATES WITH MOLECULAR MONOLAYERS DYNALOY, LLC (US) 2011-09-15 WO disclosed