SCHEMBL7210663

SCHEMBL7210663

CCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COC(=O)[C@@H](N)COP(=O)(O)O

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 9/20 0.71
LPAR3 Q9UBY5 5/20 0.71
ENPP2 Q13822 4/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
LPAR4 Q99677 2/20 0.65
LPAR5 Q9H1C0 2/20 0.65
LPAR2 Q9HBW0 2/20 0.65
CES2 O00748 1/20 0.65
LPAR6 P43657 1/20 0.65
TRPV1 Q8NER1 1/20 0.65
S1PR1 P21453 1/20 0.64
PRKCE Q02156 1/20 0.63
PRKCQ Q04759 1/20 0.63
PRKCD Q05655 1/20 0.63
PRKCA P17252 1/20 0.63
P2RY10 O00398 1/20 0.61
GPR174 Q9BXC1 1/20 0.61
SELP P16109 1/20 0.61

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
SCHEMBL9715504 1.00 LPAR1 (0.71) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL7153767 0.97 S1PR1 (0.69) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL2328212 0.93 ENPP2 (0.81) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL15328013 0.91 LPAR1 (0.85) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL173282 0.91 LPAR1 (0.85) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL200646 0.91 LPAR1 (0.85) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL7698286 0.91 LPAR1 (0.85) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL3817083 0.91 LPAR1 (0.85) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL235478 0.91 LPAR1 (0.85) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4
SCHEMBL15328011 0.91 LPAR1 (0.85) LPAR1LPAR3ENPP2SMN1; SMN2LPAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733645-B1 NOVEL SYNTHETIC PEPTIDE, LUNG SURFACTANT CONTAINING THE SAME, AND REMEDY FOR RESPIRATORY DISTRESS SYNDROME MITSUBISHI PHARMA CORP (JP) 2003-03-19 EP disclosed
US-5827825-A POLYPEPTIDE FROM THE CONDENSATION OF VARIABLE HEXA- OR HEPTAPEPTIDES WITH PEPTIDES CONTAINING TWELVE TO TWENTY UNITS OF LEUCINE AND/OR NORLEUCINE, FOR TREATMENT OF RESPIRATORY DISORDERS TOKYO TANABE COMPANY LTD. (JP) 1998-10-27 US disclosed
EP-0733645-A1 NOVEL SYNTHETIC PEPTIDE, LUNG SURFACTANT CONTAINING THE SAME, AND REMEDY FOR RESPIRATORY DISTRESS SYNDROME TOKYO TANABE COMPANY LIMITED (JP) 1996-09-25 EP disclosed