SCHEMBL2935599

SCHEMBL2935599

CCCCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 9/20 1.00
ENPP2 Q13822 8/20 1.00
LPAR3 Q9UBY5 6/20 1.00
LPAR4 Q99677 3/20 1.00
LPAR5 Q9H1C0 3/20 1.00
LPAR2 Q9HBW0 3/20 1.00
LPAR6 P43657 2/20 1.00
CES2 O00748 1/20 0.85
TRPV1 Q8NER1 1/20 0.85
SMN1; SMN2 Q16637 1/20 0.70
P2RY10 O00398 3/20 0.68
GPR174 Q9BXC1 3/20 0.68
GPR34 Q9UPC5 2/20 0.68
GPR55 Q9Y2T6 1/20 0.67

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
SCHEMBL6362553 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL8508094 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL13043253 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL2936577 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL8508530 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL8509455 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL8736955 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL8509038 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL2935665 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5
SCHEMBL8507661 1.00 LPAR1 (1.00) LPAR1ENPP2LPAR3LPAR4LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110044990-A1 ANTIBODY DESIGN USING ANTI-LIPID ANTIBODY CRYSTAL STRUCTURES LPATH, INC. 2011-02-24 US disclosed
US-7862812-B2 Methods for decreasing immune response and treating immune conditions LPATH, INC. (US) 2011-01-04 US disclosed
EP-2230312-A1 Probe compound for detecting and isolating enzymes and means and methods using the same Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2010-09-22 EP disclosed
US-20090220523-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT AND PREVENTION OF FIBROTIC, INFLAMMATORY AND NEOVASCULARIZATION CONDITIONS LPATH INC. 2009-09-03 US disclosed
US-20070280933-A1 Methods for decreasing immune response and treating immune conditions APOLLO ENDOSURGERY, INC. 2007-12-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070280933-A1 Methods for decreasing immune response and treating immune conditions LPAR1, LPAR2, S1PR1 LPAR1 1/4885ENPP2 19/4885LPAR3 10/4885
US-20110044990-A1 ANTIBODY DESIGN USING ANTI-LIPID ANTIBODY CRYSTAL STRUCTURES S1PR5, S1PR4, S1PR2 LPAR1 36/4885ENPP2 83/4885LPAR3 27/4885
US-20090220523-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT AND PREVENTION OF FIBROTIC, INFLAMMATORY AND NEOVASCULARIZATION CONDITIONS S1PR5, S1PR3, S1PR1 LPAR1 10/4885ENPP2 19/4885LPAR3 9/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.