SCHEMBL4064805

SCHEMBL4064805

CCCCCCCCC=CCCCCCCCCCCCCC(C[N+](C)(C)C)OP(=O)(O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.50
SLC6A5 Q9Y345 1/20 0.49
LPAR3 Q9UBY5 5/20 0.48
LPAR1 Q92633 7/20 0.47
LPAR2 Q9HBW0 3/20 0.47
ENPP2 Q13822 3/20 0.43
PTPN1 P18031 1/20 0.42
LPAR4 Q99677 2/20 0.41
LPAR5 Q9H1C0 2/20 0.41
CES2 O00748 1/20 0.41
LPAR6 P43657 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
S1PR1 P21453 3/20 0.41
S1PR4 O95977 2/20 0.41
S1PR3 Q99500 2/20 0.41
S1PR5 Q9H228 2/20 0.41
S1PR2 O95136 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSPO P30536 1/20 0.41
TMEM97 Q5BJF2 1/20 0.41

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
SCHEMBL9130238 1.00 SMPD1 (0.50) SMPD1SLC6A5LPAR3LPAR1LPAR2
SCHEMBL3332099 1.00 SMPD1 (0.50) SMPD1SLC6A5LPAR3LPAR1LPAR2
SCHEMBL27542771 0.91 SMPD1 (0.59) SMPD1PTPN1S1PR1S1PR4S1PR3
SCHEMBL744377 0.91 SMPD1 (0.59) SMPD1PTPN1S1PR1S1PR4S1PR3
SCHEMBL5481597 0.91 SMPD1 (0.59) SMPD1PTPN1S1PR1S1PR4S1PR3
SCHEMBL27835477 0.91 SMPD1 (0.59) SMPD1PTPN1S1PR1S1PR4S1PR3
SCHEMBL596695 0.91 SMPD1 (0.59) SMPD1PTPN1S1PR1S1PR4S1PR3
SCHEMBL1044719 0.91 SMPD1 (0.59) SMPD1PTPN1S1PR1S1PR4S1PR3
SCHEMBL27699114 0.91 SMPD1 (0.59) SMPD1PTPN1S1PR1S1PR4S1PR3
SCHEMBL9026174 0.90 SMPD1 (0.49) SMPD1LPAR3LPAR1LPAR2ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1876900-A4 PHOSPHOINOSITIDE MODULATION FOR THE TREATMENT OF ALZHEIMER'S DISEASE UNIV COLUMBIA (US) 2009-06-24 EP claimed
CN-101340918-A Novel alkyl phospholipid derivatives with reduced cytotoxicity and uses thereof AETERNA ZENTARIS GMBH (DE) 2009-01-07 CN claimed
EP-1876900-A2 PHOSPHOINOSITIDE MODULATION FOR THE TREATMENT OF ALZHEIMER'S DISEASE The Trustees of Columbia University in the City of New York (US) 2008-01-16 EP claimed
WO-2006118630-A2 PHOSPHOINOSITIDE MODULATION FOR THE TREATMENT OF ALZHEIMER'S DISEASE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2006-11-09 WO claimed
CN-117355333-A Combination comprising anti-TM 4SF1 antibody and immunotherapeutic agent and method of use thereof 安吉克公司 2024-01-05 CN disclosed
CN-112601583-A CARTyrin compositions and methods of use 波赛达治疗公司 2021-04-02 CN disclosed
CN-112218885-A VCAR compositions and methods of use 波赛达治疗公司 2021-01-12 CN disclosed
CN-111727256-A Compositions and methods for Chimeric Ligand Receptor (CLR) -mediated conditional gene expression 波赛达治疗公司 2020-09-29 CN disclosed
CN-106795550-A Genomic rearrangements associated with prostate cancer and methods of using the same 促进军事医学的亨利·M·杰克逊基金会公司 2017-05-31 CN disclosed
CN-101340918-B Novel alkyl phospholipid derivatives with reduced cytotoxicity and uses thereof AETERNA ZENTARIS GMBH 2012-10-03 CN disclosed
CN-101340918-A Novel alkyl phospholipid derivatives with reduced cytotoxicity and uses thereof AETERNA ZENTARIS GMBH (DE) 2009-01-07 CN disclosed
US-20040247659-A1 (Ester)-lysolecithins in liposomes PROFESSOR DR. JOERG EIBL (DE) 2004-12-09 US disclosed
US-20030083313-A1 Treatment of breast cancer with a liposome mixture comprising an antineoplastic alkylphospholipid and water- or lipid-soluble antiestrogen agents MAX-DELBRUCK-CENTRUM FUR MOLEKULARE MEDIZIN (DE) 2003-05-01 US disclosed
US-5436234-A Treatment of protozoal and fungal diseases, autoimmune diseases and bone marrow damage MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG (DE) 1995-07-25 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 (1 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-20040247659-A1 (Ester)-lysolecithins in liposomes LIPA, LCLAT1, CETP SMPD1 75/4885SLC6A5 1531/4885LPAR3 68/4885

“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.