SCHEMBL193245

SCHEMBL193245

CCCCCCCCCCCCCCC(F)(F)P(=O)(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 1.00
LPAR3 Q9UBY5 1/20 1.00
GGPS1 O95749 7/20 0.63
FDPS P14324 11/20 0.61
SMPD1 P17405 5/20 0.59
CES2 O00748 1/20 0.48

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
SCHEMBL1533943 0.98 LPAR1 (0.96) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL1533877 0.91 LPAR1 (0.83) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL17476332 0.83 LPAR1 (0.70) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL160868 0.81 LPAR1 (0.68) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL21101672 0.81 LPAR1 (0.68) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL6427229 0.81 LPAR1 (0.68) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL21835985 0.80 LPAR1 (0.67) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL9110451 0.78 LPAR1 (0.64) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL21101802 0.77 GGPS1 (0.68) LPAR1LPAR3GGPS1FDPSSMPD1
SCHEMBL18114319 0.77 GGPS1 (0.68) LPAR1LPAR3GGPS1FDPSSMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1678096-A4 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE UNIV TENNESSEE RES CORP (US) 2007-04-18 EP claimed
JP-2007508324-A 2007-04-05 JP claimed
EP-1678096-A2 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 2006-07-12 EP claimed
US-20060009507-A1 Thio-phosphoric and -phosphorous acid derivatives; treating cancer, wounds, skin disorders and apoptosis; preserving or restoring function in a cell, tissue or organ; culturing cells; preserving organ or tissue function; and enhancing cell proliferation UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2006-01-12 US claimed
WO-2005032494-A2 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2005-04-14 WO claimed
EP-2481743-B1 LPA receptor agonists and antagonists and methods of use UNIV TENNESSEE RES FOUND (US) 2017-03-22 EP disclosed
EP-2433946-B1 LPA receptor agonists and antagonists and methods of use UNIV TENNESSEE RES FOUNDATION (US) 2016-04-20 EP disclosed
EP-2767541-A1 LPA receptor agonists and antagonists Rxbio, Inc. (US) 2014-08-20 EP disclosed
EP-2262371-B1 LPA RECEPTOR AGONISTS AND ANTAGONISTS RXBIO INC (US) 2014-01-01 EP disclosed
EP-2481743-A1 LPA receptor agonists and antagonists and methods of use UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2012-08-01 EP disclosed
US-20120135967-A1 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE MILLER DUANE D (US) 2012-05-31 US disclosed
EP-2433946-A1 LPA receptor agonists and antagonists and methods of use University of Tennessee Research Foundation (US) 2012-03-28 EP disclosed
EP-2262371-A1 LPA RECEPTOR AGONISTS AND ANTAGONISTS Rxbio, Inc. (US) 2010-12-22 EP disclosed
WO-2010051053-A1 LPA RECEPTOR AGONISTS AND ANTAGONISTS RXBIO, INC. (US) 2010-05-06 WO disclosed
US-20080090783-A1 lysophosphatidic acid receptor modulator; thiophosphoric acid O-[7-(4-octyl-phenyl)-heptyl] ester; treating cancer, wounds, skin disorders and apoptosis; preserving or restoring function in a cell, tissue or organ; culturing cells; preserving organ or tissue function; and enhancing cell proliferation MILLER DUANE D 2008-04-17 US disclosed
US-7217704-B2 LPA receptor agonists and antagonists and methods of use THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2007-05-15 US disclosed
EP-1678096-A4 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE UNIV TENNESSEE RES CORP (US) 2007-04-18 EP disclosed
EP-1678096-A2 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE THE UNIVERSITY OF TENNESSEE RESEARCH CORPORATION (US) 2006-07-12 EP disclosed
US-20060009507-A1 Thio-phosphoric and -phosphorous acid derivatives; treating cancer, wounds, skin disorders and apoptosis; preserving or restoring function in a cell, tissue or organ; culturing cells; preserving organ or tissue function; and enhancing cell proliferation UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2006-01-12 US disclosed
WO-2005032494-A2 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2005-04-14 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 (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-20060009507-A1 Thio-phosphoric and -phosphorous acid derivatives; treating cancer, wounds, skin disorders and apoptosis; preserving or restoring function in a cell, tissue or organ; culturing cells; preserving organ or tissue function; and enhancing cell proliferation LPAR1, LPAR6, LPAR2 LPAR1 1/4885LPAR3 6/4885GGPS1 832/4885
US-20120135967-A1 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE LPAR1, LPAR2, LPAR4 LPAR1 1/4885LPAR3 5/4885GGPS1 1306/4885
US-20080090783-A1 lysophosphatidic acid receptor modulator; thiophosphoric acid O-[7-(4-octyl-phenyl)-heptyl] ester; treating cancer, wounds, skin disorders and apoptosis; preserving or restoring function in a cell, tissue or organ; culturing cells; preserving organ or tissue function; and enhancing cell proliferation LPAR1, LPAR4, LPAR2 LPAR1 1/4885LPAR3 6/4885GGPS1 833/4885

“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.