SCHEMBL1333581

SCHEMBL1333581

CCCCCOC[C@H](COP(=O)([O-])[O-])OCCCCC.[Na+].[Na+]

nearest known ligand 0.69

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPAR1 Q92633 9/20 0.69
▸ LPAR3 Q9UBY5 9/20 0.69
▸ LPAR2 Q9HBW0 6/20 0.60
▸ LPAR5 Q9H1C0 6/20 0.56
▸ LPAR6 P43657 5/20 0.56
▸ LPAR4 Q99677 5/20 0.56
▸ PRKD3 O94806 1/20 0.51
▸ PRKCG P05129 1/20 0.51
▸ PRKCB P05771 1/20 0.51
▸ PRKCA P17252 1/20 0.51
▸ PRKCH P24723 1/20 0.51
▸ AKT1 P31749 1/20 0.51
▸ PRKCI P41743 1/20 0.51
▸ PRKCE Q02156 1/20 0.51
▸ PRKCQ Q04759 1/20 0.51
▸ PRKCZ Q05513 1/20 0.51
▸ PRKCD Q05655 1/20 0.51
▸ PRKD1 Q15139 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ MAPK1 P28482 1/20 0.51

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
Monoethanolamine SCHEMBL27910098 0.89 LPAR1 (0.64) LPAR1LPAR3LPAR2LPAR5LPAR6
Glycerin SCHEMBL28048922 0.89 LPAR1 (0.64) LPAR1LPAR3LPAR2LPAR5LPAR6
Monoethanolamine SCHEMBL28048917 0.89 LPAR1 (0.64) LPAR1LPAR3LPAR2LPAR5LPAR6
Choline SCHEMBL28147311 0.85 LPAR1 (0.60) LPAR1LPAR3LPAR2LPAR5LPAR6
Choline SCHEMBL28271776 0.85 LPAR1 (0.60) LPAR1LPAR3LPAR2LPAR5LPAR6
Choline SCHEMBL28104751 0.85 LPAR1 (0.60) LPAR1LPAR3LPAR2LPAR5LPAR6
SCHEMBL7588441 0.85 LPAR1 (0.77) LPAR1LPAR3LPAR2LPAR5LPAR6
SCHEMBL10715915 0.84 LPAR3 (0.61) LPAR1LPAR3LPAR2LPAR5LPAR6
Serine SCHEMBL27927630 0.83 LPAR1 (0.57) LPAR1LPAR3LPAR2LPAR5LPAR6
SCHEMBL2732573 0.83 LPAR3 (0.97) LPAR1LPAR3LPAR2LPAR5LPAR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220023447-A1 FIBRIN-TARGETED POLYMERIZED SHELL LIPID MICROBUBBLES FOR DIAGNOSTIC AND THERAPEUTIC APPLICATIONS NANOVALENT PHARMACEUTICALS INC (US) 2022-01-27 — — US disclosed
US-10413871-B2 Stabilization of biomimetic membranes DANISCO US INC (US) 2019-09-17 — — US disclosed
EP-2909230-B1 STABILIZATION OF BIOMIMETIC MEMBRANES DANISCO US INC (US) 2019-05-22 — — EP disclosed
US-20190099725-A1 STABILIZATION OF BIOMIMETIC MEMBRANES DANISCO US INC (US) 2019-04-04 — — US disclosed
US-10226744-B2 Stabilization of biomimetic membranes DANISCO US INC (US) 2019-03-12 — — US disclosed
EP-2341933-B1 LIPIDATED IMIDAZOQUINOLINE DERIVATIVES GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2017-11-22 — — EP disclosed
US-20150273407-A1 STABILIZATION OF BIOMIMETIC MEMBRANES DANISCO US INC. 2015-10-01 — — US disclosed
EP-2909230-A1 STABILIZATION OF BIOMIMETIC MEMBRANES Danisco US Inc. (US) 2015-08-26 — — EP disclosed
US-8946421-B2 Lipidated imidazoquinoline derivatives GLAXOSMITHKLINE BIOLOGICALS S.A. (BE) 2015-02-03 — — US disclosed
US-20140323731-A1 LIPIDATED IMIDAZOQUINOLINE DERIVATIVES GLAXOSMITHKLINE BIOLOGICALS S.A. (BE) 2014-10-30 — — US disclosed
US-20140199233-A1 Enhanced Growth Inhibition of Osteosarcoma by Cytotoxic Polymerized Liposomal Nanoparticles Targeting the Alcam Cell Surface Receptor THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-07-17 — — US disclosed
WO-2014063097-A1 STABILIZATION OF BIOMIMETIC MEMBRANES DANISCO US INC. (US) 2014-04-24 — — WO disclosed
US-8624029-B2 Lipidated imidazoquinoline derivatives GLAXOSMITHKLINE BIOLOGICALS S.A. (BE) 2014-01-07 — — US disclosed
US-20130129635-A1 POLYMERIZED SHELL LIPID MICROBUBBLES AND USES THEREOF Wilson Sonsini Goodrch & Rosati (US) 2013-05-23 — — US disclosed
WO-2011149985-A1 POLYMERIZED SHELL LIPID MICROBUBBLES AND USES THEREOF NANOVALENT PHARMACEUTICALS, INC. (US) 2011-12-01 — — WO disclosed
US-20110282061-A1 Lipidated Imidazoquinoline Derivatives GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2011-11-17 — — US disclosed
EP-1056473-B1 TARGETED DELIVERY OF BIOLOGICALLY ACTIVE MEDIA BRACCO RESEARCH SA (CH) 2005-05-25 — — EP disclosed
US-6258378-B1 INJECTING SUSPENSION OF MICROBALLOONS CARRYING ENTRAPPED GAS AND LIPOSOME VESICLES FILLED WITH DRUG OR DIAGNOSTIC LIQUID; ULTRASONIC IRRADIATION TO EXPLODE BRACCO RESEARCH S.A. (CH) 2001-07-10 — — 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 (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-20140323731-A1 LIPIDATED IMIDAZOQUINOLINE DERIVATIVES IFNG, IRF3, IFNAR1 LPAR1 433/4885LPAR3 327/4885LPAR2 385/4885
US-20110282061-A1 Lipidated Imidazoquinoline Derivatives IFNG, IRF3, IFNAR1 LPAR1 432/4885LPAR3 329/4885LPAR2 386/4885

“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.

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