SCHEMBL2224902

SCHEMBL2224902

CCCCCCCCC(CCCCCCCC)(OP(=O)(O)OP(=O)(O)O)C(O)CO

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.46
GGPS1 O95749 6/20 0.40
LPAR3 Q9UBY5 4/20 0.40
LPAR1 Q92633 3/20 0.40
LPAR2 Q9HBW0 2/20 0.40
FDPS P14324 9/20 0.39
LPAR5 Q9H1C0 1/20 0.38

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
SCHEMBL6854212 0.99 SMPD1 (0.44) SMPD1GGPS1LPAR3LPAR1LPAR2
SCHEMBL11024893 0.88 SMPD1 (0.56) SMPD1GGPS1LPAR3LPAR1LPAR2
SCHEMBL11021842 0.88 SMPD1 (0.56) SMPD1GGPS1LPAR3LPAR1LPAR2
Monoethanolamine SCHEMBL27656170 0.82 SMPD1 (0.51) SMPD1GGPS1LPAR3LPAR1LPAR2
Monoethanolamine SCHEMBL27867926 0.82 SMPD1 (0.51) SMPD1GGPS1LPAR3LPAR1LPAR2
SCHEMBL9115436 0.81 PLA2G2C (0.43) SMPD1GGPS1LPAR3LPAR1LPAR2
SCHEMBL8472151 0.80 PLA2G2C (0.41) SMPD1GGPS1LPAR3LPAR1LPAR2
SCHEMBL19471840 0.79 GPR55 (0.45) SMPD1GGPS1
SCHEMBL10596171 0.79 GPR55 (0.45) SMPD1GGPS1
SCHEMBL5962134 0.77 LPAR1 (0.43) LPAR3LPAR1LPAR2LPAR5

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011091167-A2 LYSOPHOSPHATIDIC ACID RECEPTOR TARGETING FOR SCLERODERMA AND OTHER FIBROTIC DISEASES THE GENERAL HOSPITAL CORPORATION (US) 2011-07-28 WO disclosed
US-20100239501-A1 GENE SENSITIVE TO BONE/JOINT DISEASE AND USE THEREOF RIKEN (JP) 2010-09-23 US disclosed
US-20100143381-A1 LYSOPHOSPHATIDIC ACID RECEPTOR TARGETING FOR LUNG DISEASE THE GENERAL HOSPITAL CORPORATION 2010-06-10 US disclosed
EP-2153847-A1 GENE SENSITIVE TO BONE/JOINT DISEASE AND USE THEREOF Riken (JP) 2010-02-17 EP disclosed
WO-2008112201-A2 LYSOPHOSPHATIDIC ACID RECEPTOR TARGETING FOR LUNG DISEASE THE GENERAL HOSPITAL CORPORATION (US) 2008-09-18 WO disclosed
EP-1918287-A2 LPA receptor agonists and antagonists and methods of use THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 2008-05-07 EP disclosed
EP-1263752-B1 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE UNIV TENNESSEE RES CORP (US) 2007-12-05 EP disclosed
EP-1613298-A4 LYSOPHOSPHATIDIC ACID ANALOGS AND INHIBITION OF NEOINTIMA FORMATION UNIV TENNESSEE RES FOUNDATION (US) 2007-10-03 EP disclosed
EP-1427424-A4 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE UNIV TENNESSEE RES CORP (US) 2006-12-13 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
US-6875757-B2 For therapy of cancer, enhancing cell proliferation, and wound UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2005-04-05 US 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
EP-1427424-A2 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 2004-06-16 EP disclosed
EP-1263752-A4 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE UNIV TENNESSEE RES CORP (US) 2003-07-30 EP disclosed
US-20030130237-A1 LPA receptor agonists and antagonists and methods of use MILLER DUANE D (US) 2003-07-10 US disclosed
WO-2003024402-A2 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 2003-03-27 WO disclosed
US-20030027800-A1 LPA receptor agonists and antagonists and methods of use NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-02-06 US disclosed
EP-1263752-A2 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 2002-12-11 EP disclosed
WO-2001071022-A2 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 2001-09-27 WO 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 (2 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-20030027800-A1 LPA receptor agonists and antagonists and methods of use LPAR1, LPAR2, LPAR3 SMPD1 145/4885GGPS1 778/4885LPAR3 3/4885
US-20030130237-A1 LPA receptor agonists and antagonists and methods of use LPAR1, LPAR2, LPAR5 SMPD1 112/4885GGPS1 1147/4885LPAR3 4/4885

“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.