SCHEMBL4950657

SCHEMBL4950657

CCCCCCCCCNC(=O)C(CO)NC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 1/20 0.51
SIRT1 Q96EB6 1/20 0.51
FNTA P49354 1/20 0.49
FNTB P49356 1/20 0.49
EPHX1 P07099 6/20 0.49
NAAA Q02083 3/20 0.48
RRM1 P23921 1/20 0.47
DPP7 Q9UHL4 1/20 0.47
LPAR3 Q9UBY5 4/20 0.47
LPAR1 Q92633 2/20 0.46
TLR2 O60603 1/20 0.46
GNAI3 P08754 1/20 0.45
GNAO1 P09471 1/20 0.45
GNAI1 P63096 1/20 0.45

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
SCHEMBL4948525 1.00 SIRT6 (0.51) SIRT6SIRT1FNTAFNTBEPHX1
SCHEMBL4949210 1.00 SIRT6 (0.51) SIRT6SIRT1FNTAFNTBEPHX1
SCHEMBL9306476 0.98 SIRT6 (0.49) SIRT6SIRT1FNTAFNTBEPHX1
SCHEMBL9306465 0.98 SIRT6 (0.49) SIRT6SIRT1FNTAFNTBEPHX1
SCHEMBL506608 0.87 SIRT6 (0.67) SIRT6SIRT1EPHX1NAAARRM1
SCHEMBL506609 0.87 SIRT6 (0.67) SIRT6SIRT1EPHX1NAAARRM1
SCHEMBL25021992 0.84 LPAR3 (0.65) NAAALPAR3LPAR1TLR2
SCHEMBL19839845 0.84 SIRT6 (0.63) SIRT6SIRT1FNTAFNTBEPHX1
SCHEMBL9306626 0.83 SIRT6 (0.48) SIRT6SIRT1FNTAFNTBEPHX1
SCHEMBL9306622 0.83 SIRT6 (0.48) SIRT6SIRT1FNTAFNTBEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-1427424-A4 LPA RECEPTOR AGONISTS AND ANTAGONISTS AND METHODS OF USE UNIV TENNESSEE RES CORP (US) 2006-12-13 EP disclosed
US-20050261252-A1 LPA receptor agonists and antagonists and methods of use MILLER DUANE D 2005-11-24 US disclosed
US-6875757-B2 For therapy of cancer, enhancing cell proliferation, and wound UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2005-04-05 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 (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-20050261252-A1 LPA receptor agonists and antagonists and methods of use LPAR1, LPAR2, LPAR3 SIRT6 3616/4885SIRT1 2133/4885FNTA 1405/4885
US-20030027800-A1 LPA receptor agonists and antagonists and methods of use LPAR1, LPAR2, LPAR3 SIRT6 3616/4885SIRT1 2133/4885FNTA 1405/4885
US-20030130237-A1 LPA receptor agonists and antagonists and methods of use LPAR1, LPAR2, LPAR5 SIRT6 3299/4885SIRT1 1855/4885FNTA 1931/4885

“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.