SCHEMBL234818

SCHEMBL234818

CCCCCCCCCC=CC=CC=CC=CC=CC=CC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)O

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.69
LPAR1 Q92633 9/20 0.66
LPAR3 Q9UBY5 6/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
LPAR4 Q99677 2/20 0.61
LPAR5 Q9H1C0 2/20 0.61
LPAR2 Q9HBW0 2/20 0.61
CES2 O00748 1/20 0.61
LPAR6 P43657 1/20 0.61
TRPV1 Q8NER1 1/20 0.61
S1PR1 P21453 1/20 0.57
RECQL P46063 1/20 0.56
BLM P54132 1/20 0.56
TDP1 Q9NUW8 1/20 0.56

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
SCHEMBL2947211 1.00 ENPP2 (0.69) ENPP2LPAR1LPAR3SMN1; SMN2LPAR4
SCHEMBL1296442 0.99 ENPP2 (0.71) ENPP2LPAR1LPAR3SMN1; SMN2LPAR4
SCHEMBL1296633 0.99 ENPP2 (0.71) ENPP2LPAR1LPAR3SMN1; SMN2LPAR4
SCHEMBL1295914 0.99 ENPP2 (0.71) ENPP2LPAR1LPAR3SMN1; SMN2LPAR4
SCHEMBL1296721 0.99 ENPP2 (0.71) ENPP2LPAR1LPAR3SMN1; SMN2LPAR4
SCHEMBL1296948 0.91 LPAR1 (0.80) ENPP2LPAR1LPAR3SMN1; SMN2LPAR4
SCHEMBL234397 0.91 ENPP2 (0.56) ENPP2LPAR1LPAR3SMN1; SMN2LPAR4
SCHEMBL3410348 0.91 ENPP2 (0.56) ENPP2LPAR1LPAR3SMN1; SMN2LPAR4
SCHEMBL1899147 0.91 PRKCA (0.62) ENPP2LPAR1LPAR3RECQLBLM
SCHEMBL1903151 0.91 PRKCA (0.62) ENPP2LPAR1LPAR3RECQLBLM

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-2578237-A1 Compositions and methods for enhancing contrast in imaging Marval Biosciences, Inc. (US) 2013-04-10 EP disclosed
EP-2410990-A1 COMPOSITIONS AND METHODS FOR ENHANCING CONTRAST IN IMAGING Marval Biosciences, Inc. (US) 2012-02-01 EP disclosed
US-20120003159-A1 COMPOSITIONS AND METHODS FOR ENHANCING CONTRAST IN IMAGING BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-01-05 US disclosed
WO-2010107990-A1 COMPOSITIONS AND METHODS FOR ENHANCING CONTRAST IN IMAGING MARVAL BIOSCIENCES, INC. (US) 2010-09-23 WO disclosed
US-7785568-B2 Sterically stabilized liposomes with hydrophilic polymers on surface; computed tomography MARVAL BIOSCIENCES, INC. (US) 2010-08-31 US disclosed
US-20080131369-A1 Sterically stabilized liposomes with hydrophilic polymers on surface; computed tomography MARVEL THERAPEUTICS (US) 2008-06-05 US disclosed
US-20070212303-A1 Sterically stabilized liposomes with hydrophilic polymers on surface; computed tomography MARVAL PHARMA, INC. 2007-09-13 US disclosed