SCHEMBL19169487

SCHEMBL19169487

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nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.50
BLM P54132 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PPARD Q03181 1/20 0.42
BTN3A1 O00481 4/20 0.42
LPAR3 Q9UBY5 3/20 0.36
LPAR1 Q92633 2/20 0.36
LPAR2 Q9HBW0 2/20 0.36
KDM4E B2RXH2 1/20 0.35
MMP2 P08253 1/20 0.35
THRB P10828 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.33
SMPD1 P17405 2/20 0.32

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
SCHEMBL1131657 1.00 FDPS (0.50) FDPSBLMTDP1PPARDBTN3A1
SCHEMBL6562094 0.88 PPARD (0.46) FDPSBLMTDP1PPARDLPAR3
SCHEMBL12259745 0.87 FDPS (0.43) FDPSBLMTDP1PPARDBTN3A1
SCHEMBL28063817 0.85 PPARD (0.44) FDPSBLMTDP1PPARDLPAR3
SCHEMBL28299764 0.80 PPARD (0.41) FDPSBLMTDP1PPARDLPAR3
SCHEMBL8529848 0.78 PPARD (0.39) FDPSBLMTDP1PPARDKDM4E
SCHEMBL13459272 0.78 BTN3A1 (0.48) FDPSBLMTDP1PPARDBTN3A1
Pyrophosphoric Acid SCHEMBL5822274 0.78 FDPS (0.71) FDPSBLMTDP1PPARDBTN3A1
Pyrophosphoric Acid SCHEMBL2426695 0.78 FDPS (0.71) FDPSBLMTDP1PPARDBTN3A1
SCHEMBL1661755 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017127430-A1 IRAK4 INHIBITING AGENTS BIOGEN MA INC. (US) 2017-07-27 WO disclosed
US-9683330-B2 Wet paper web transfer belt ICHIKAWA CO., LTD (JP) 2017-06-20 US disclosed
US-9589814-B2 Semiconductor device packages and methods of manufacturing the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2017-03-07 US disclosed
US-20160244514-A1 Humanized Antibody GENENTECH, INC. (US) 2016-08-25 US disclosed
US-20160213763-A1 NOVEL GLYCAN CONJUGATES AND METHODS OF USE THEREOF ACADEMIA SINICA (TW) 2016-07-28 US disclosed
US-9211300-B2 4′-fluoro nucleosides for the treatment of HCV IDENIX PHARMACEUTICALS LLC (US) 2015-12-15 US disclosed
WO-2015161137-A1 3'-SUBSTITUTED METHYL OR ALKYNYL NUCLEOSIDES FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2015-10-22 WO disclosed
WO-2015017713-A1 D-AMINO ACID PHOSPHORAMIDATE PRONUCLEOTIDES OF HALOGENO PYRIMIDINE COMPOUNDS FOR LIVER DISEASE IDENIX PHARMACEUTICALS, INC. (US) 2015-02-05 WO disclosed
WO-2014179765-A2 NOVEL HUMAN MIRNAS FOR USE IN DIAGNOSIS, PROGNOSIS AND THERAPY OF HUMAN CONDITIONS AND DISEASES THOMAS JEFFERSON UNIVERSITY (US) 2014-11-06 WO disclosed
WO-2014137454-A1 METHODS AND COMPOSITIONS TO INHIBIT THE ASSEMBLAGE OF MICROBIAL CELLS IRREVERSIBLY ASSOCIATED WITH SURFACES OF MEDICAL DEVICES TYRX, INC. (US) 2014-09-12 WO disclosed
US-8779119-B2 Metal salt of crosslinked cellulose derivative JNC CORPORATION (JP) 2014-07-15 US disclosed
US-20140178338-A1 4'-FLUORO NUCLOSIDES FOR THE TREATMENT OF HCV UNIVERSITE DE MONTPELLIER (FR) 2014-06-26 US disclosed
US-8455628-B2 PP1 ligands INTREXON CORPORATION (US) 2013-06-04 US disclosed
US-20130064843-A1 Identification of conserved peptide blocks in homologous polypeptides DANA-FARBER CANCER INSTITUTE, INC. (US) 2013-03-14 US disclosed
US-20110263539-A1 SHIP 1 MODULATOR COMPOUNDS THE UNIVERSITY OF BRITISH COLUMBIA (CA) 2011-10-27 US disclosed
US-20100317844-A1 METAL SALT OF CROSSLINKED CELLULOSE DERIVATIVE CHISSO CORPORATION 2010-12-16 US disclosed
US-20100029674-A1 Methods of Using Phosphoantigen for the Treatment of Cancer INNATE PHARMA, S.A. (FR) 2010-02-04 US disclosed
US-20100003217-A1 Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections CRETTON-SCOTT ERIKA 2010-01-07 US disclosed
US-20080300222-A1 Phosphoantigen Salts Of Organic Bases And Methods For Their Crystallization INNATE PHARMA (FR) 2008-12-04 US disclosed
US-20080108569-A1 PH domain leucine-rich repeat protin phosphatase (PHLPP), inactivates Akt (protein kinase B) by directly dephosphorylating the hydrophobic domain of the C-terminus; prevents cancer, Alzheimer's disease, diabetes, diabetic macular edema and cardiovascular disease, antiapoptosis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2008-05-08 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 (7 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-20100003217-A1 Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections HAVCR2, PYGL, GOT1 FDPS 475/4885BLM 806/4885TDP1 2616/4885
US-20100029674-A1 Methods of Using Phosphoantigen for the Treatment of Cancer CD4, CD74, TP53 FDPS 4547/4885BLM 4357/4885TDP1 1907/4885
US-20110263539-A1 SHIP 1 MODULATOR COMPOUNDS PPM1F, PPM1D, PPP1R1B FDPS 2940/4885BLM 4175/4885TDP1 1449/4885
US-20080300222-A1 Phosphoantigen Salts Of Organic Bases And Methods For Their Crystallization HLA-B, LCK, HLA-A FDPS 1119/4885BLM 1318/4885TDP1 777/4885
US-20140178338-A1 4'-FLUORO NUCLOSIDES FOR THE TREATMENT OF HCV FBL, HNRNPLL, SLC28A1 FDPS 937/4885BLM 1357/4885TDP1 694/4885
US-20160213763-A1 NOVEL GLYCAN CONJUGATES AND METHODS OF USE THEREOF B3GAT3, ST6GAL1, STT3A FDPS 1237/4885BLM 3220/4885TDP1 959/4885
US-20100317844-A1 METAL SALT OF CROSSLINKED CELLULOSE DERIVATIVE OGA, SLC5A1, OSTC FDPS 4825/4885BLM 1570/4885TDP1 3661/4885

“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.