SCHEMBL5500723

SCHEMBL5500723

C=CCOCC=C.O=P(O)(O)OCC(O)CO

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
LPAR5 Q9H1C0 2/20 0.41
MPI P34949 1/20 0.41
PGK1 P00558 1/20 0.39
PGK2 P07205 1/20 0.39
PGD P52209 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
LPAR2 Q9HBW0 2/20 0.36
LPAR3 Q9UBY5 2/20 0.36
LPAR1 Q92633 4/20 0.35
LPAR6 P43657 1/20 0.35
LPAR4 Q99677 1/20 0.35
ENPP2 Q13822 1/20 0.35

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
SCHEMBL9285761 0.86 CA1 (0.53) CA1CA2CA7LPAR5MPI
SCHEMBL4563781 0.86 CA1 (0.53) CA1CA2CA7LPAR5MPI
SCHEMBL585036 0.86 CA1 (0.53) CA1CA2CA7LPAR5MPI
SCHEMBL28051142 0.85 MPI (0.38) CA1CA2CA7LPAR5MPI
Phosphoric Acid SCHEMBL30509812 0.84 CA1 (0.52) CA1CA2CA7LPAR5MPI
SCHEMBL27973226 0.84 CA1 (0.52) CA1CA2CA7LPAR5MPI
Phosphoric Acid SCHEMBL170152 0.84 CA1 (0.55) CA1CA2CA7LPAR5SMN1; SMN2
SCHEMBL7341 0.83 PGK1 (0.52) LPAR5MPIPGK1PGK2PGD
SCHEMBL14278848 0.83 PGK1 (0.52) LPAR5MPIPGK1PGK2PGD
SCHEMBL213379 0.83 PGK1 (0.52) LPAR5MPIPGK1PGK2PGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1613298-A4 LYSOPHOSPHATIDIC ACID ANALOGS AND INHIBITION OF NEOINTIMA FORMATION UNIV TENNESSEE RES FOUNDATION (US) 2007-10-03 EP claimed
EP-1613298-A2 LYSOPHOSPHATIDIC ACID ANALOGS AND INHIBITION OF NEOINTIMA FORMATION The University of Tennessee Research Foundation (US) 2006-01-11 EP claimed
WO-2004091496-A2 LYSOPHOSPHATIDIC ACID ANALOGS AND INHIBITION OF NEOINTIMA FORMATION THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2004-10-28 WO claimed
US-20040204383-A1 Lysophosphatidic acid analogs and inhibition of neointima formation UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION, THE 2004-10-14 US claimed
EP-1613298-A4 LYSOPHOSPHATIDIC ACID ANALOGS AND INHIBITION OF NEOINTIMA FORMATION UNIV TENNESSEE RES FOUNDATION (US) 2007-10-03 EP disclosed
EP-1613298-A2 LYSOPHOSPHATIDIC ACID ANALOGS AND INHIBITION OF NEOINTIMA FORMATION The University of Tennessee Research Foundation (US) 2006-01-11 EP disclosed
WO-2004091496-A2 LYSOPHOSPHATIDIC ACID ANALOGS AND INHIBITION OF NEOINTIMA FORMATION THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2004-10-28 WO disclosed
US-20040204383-A1 Lysophosphatidic acid analogs and inhibition of neointima formation UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION, THE 2004-10-14 US disclosed