SCHEMBL907527

SCHEMBL907527

C=CC(=O)NCCCCCCOP(=O)(O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.54
LPAR2 Q9HBW0 7/20 0.54
ZDHHC20 Q5W0Z9 1/20 0.54
ZDHHC2 Q9UIJ5 1/20 0.54
LPAR1 Q92633 5/20 0.46
TGM2 P21980 1/20 0.43
ENPP2 Q13822 1/20 0.40
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
S1PR2 O95136 2/20 0.39
S1PR1 P21453 2/20 0.39
S1PR3 Q99500 2/20 0.39
S1PR5 Q9H228 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CYP3A4 P08684 1/20 0.36

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
SCHEMBL24359827 0.98 LPAR3 (0.51) LPAR3LPAR2ZDHHC20ZDHHC2LPAR1
SCHEMBL16372096 0.93 LPAR3 (0.49) LPAR3LPAR2ZDHHC20ZDHHC2LPAR1
Trimethylammonium SCHEMBL29164957 0.87 ZDHHC20 (0.47) LPAR3LPAR2ZDHHC20ZDHHC2LPAR1
SCHEMBL907318 0.86 ALDH1A1 (0.45) LPAR3LPAR2ZDHHC20ZDHHC2LPAR1
SCHEMBL17636271 0.84 ZDHHC20 (0.53) LPAR3LPAR2ZDHHC20ZDHHC2LPAR1
SCHEMBL16353959 0.83 ZDHHC20 (0.49) LPAR3LPAR2ZDHHC20ZDHHC2TGM2
SCHEMBL14996294 0.81 ZDHHC20 (0.65) ZDHHC20ZDHHC2TGM2ALDH1A1TSHR
SCHEMBL23281607 0.80 ALDH1A1 (0.39) LPAR3LPAR2ZDHHC20ZDHHC2LPAR1
SCHEMBL270209 0.80 ZDHHC20 (0.79) ZDHHC20ZDHHC2TGM2ALDH1A1TSHR
SCHEMBL269468 0.80 ZDHHC20 (0.79) ZDHHC20ZDHHC2TGM2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10478384-B2 Dental composition ZIMMER DENTAL, INC. (US) 2019-11-19 US claimed
EP-2277496-B1 Dental material containing surface-modified fillers IVOCLAR VIVADENT AG (LI) 2016-03-30 EP claimed
US-20140161901-A1 DENTAL COMPOSITION ZIMMER DENTAL, INC. (US) 2014-06-12 US claimed
US-8367748-B2 Surface-modified fillers IVOCLAR VIVADENT AG (LI) 2013-02-05 US claimed
US-8211956-B2 Universal dental adhesion-promoter composition IVOCLAR VIVADENT AG (LI) 2012-07-03 US claimed
US-10478384-B2 Dental composition ZIMMER DENTAL, INC. (US) 2019-11-19 US disclosed
EP-2777687-B1 Dental primer formulation IVOCLAR VIVADENT AG (LI) 2018-11-07 EP disclosed
US-9974716-B2 Dental primer formulation IVOCLAR VIVADENT AG (LI) 2018-05-22 US disclosed
EP-2277496-B1 Dental material containing surface-modified fillers IVOCLAR VIVADENT AG (LI) 2016-03-30 EP disclosed
US-20160022549-A1 DENTAL PRIMER FORMULATION IVOCLAR VIVADENT AG (LI) 2016-01-28 US disclosed
WO-2014139629-A1 DENTAL PRIMER FORMULATION IVOCLAR VIVADENT AG (LI) 2014-09-18 WO disclosed
EP-2777687-A1 Dental primer formulation Ivoclar Vivadent AG (LI) 2014-09-17 EP disclosed
EP-2277496-A1 Dental material containing surface-modified fillers Ivoclar Vivadent AG (LI) 2011-01-26 EP disclosed
EP-1716836-B1 Surface-modified fillers IVOCLAR VIVADENT AG (LI) 2011-01-19 EP disclosed
US-20100240796-A1 UNIVERSAL DENTAL ADHESION-PROMOTER COMPOSITION IVOCLAR VIVADENT AG (LI) 2010-09-23 US disclosed
EP-2229930-A1 Dental universal adhesive compound Ivoclar Vivadent AG (LI) 2010-09-22 EP disclosed
US-20090186960-A1 DENTAL MATERIALS WITH SURFACE-FUNCTIONALIZED FILLERS IVOCLAR VIVADENT AG (LI) 2009-07-23 US disclosed
EP-2080503-A1 Dental materials with surface functional fillers Ivoclar Vivadent AG (LI) 2009-07-22 EP disclosed
EP-1716836-A1 Surface-modified fillers Ivoclar Vivadent AG (LI) 2006-11-02 EP disclosed
US-20060247329-A1 Surface-modified fillers IVOCLAR VIVADENT AG (LI) 2006-11-02 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 (6 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-10478384-B2 Dental composition CAD, PPIP5K2, PTH1R LPAR3 2504/4885LPAR2 2896/4885ZDHHC20 4692/4885
US-20160022549-A1 DENTAL PRIMER FORMULATION F12, H1-2, H1-0 LPAR3 962/4885LPAR2 1639/4885ZDHHC20 3431/4885
US-20140161901-A1 DENTAL COMPOSITION CAD, PPIP5K2, PTH1R LPAR3 2504/4885LPAR2 2896/4885ZDHHC20 4692/4885
US-20090186960-A1 DENTAL MATERIALS WITH SURFACE-FUNCTIONALIZED FILLERS ITGAM, ITGA5, ITGA1 LPAR3 3382/4885LPAR2 4458/4885ZDHHC20 3076/4885
US-20060247329-A1 Surface-modified fillers MSR1, HRH4, OR10J3 LPAR3 675/4885LPAR2 2413/4885ZDHHC20 1730/4885
US-20100240796-A1 UNIVERSAL DENTAL ADHESION-PROMOTER COMPOSITION CDH1, CAD, CD44 LPAR3 3081/4885LPAR2 3275/4885ZDHHC20 4064/4885

“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.