SCHEMBL3082847

SCHEMBL3082847

O=C(O)CP(=O)(O)OC1[C@H](OP(=O)(O)CC(=O)O)CN(CCc2ccccc2)C[C@H]1OP(=O)(O)CC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.46
OPRD1 P41143 1/20 0.46
HTR2A P28223 1/20 0.40
GBA1 P04062 1/20 0.40
AGTR2 P50052 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KCNH2 Q12809 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
DRD4 P21917 1/20 0.38

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
SCHEMBL6407587 0.95 OPRM1 (0.42) OPRM1OPRD1HTR2AGBA1AGTR2
SCHEMBL3073767 0.87 GBA1 (0.45) OPRM1OPRD1HTR2AGBA1MEN1
SCHEMBL3085645 0.83 PDPK1 (0.50) OPRM1OPRD1HTR2AGBA1MEN1
SCHEMBL3075531 0.81 OPRM1 (0.44) OPRM1OPRD1HTR2AGBA1MEN1
SCHEMBL7046732 0.69 PDPK1 (0.53) GBA1SIGMAR1
SCHEMBL27672080 0.69 S1PR5 (0.71) OPRM1OPRD1HTR2AGBA1AGTR2
SCHEMBL3063424 0.68 MEN1 (0.34) MEN1KMT2A
SCHEMBL11227003 0.66 GBA1 (0.61) OPRM1OPRD1GBA1SIGMAR1
SCHEMBL7003079 0.66 SLC6A3 (0.61) HTR2AGBA1KCNH2SIGMAR1
Hydrochloric Acid SCHEMBL28290331 0.65 OPRM1 (0.51) OPRM1OPRD1HTR2AGBA1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100261682-A1 Method and Means for the Treatment of Cachexia BIONERIS AB 2010-10-14 US claimed
US-20160074421-A1 METHOD FOR THE TREATMENT OF DISEASES CAUSED BY HAEMORRHAGIC VIRUSES AND COMPOUNDS FOR USE IN SAID TREATMENT SIRÈN MATTI (FI) 2016-03-17 US disclosed
US-20100261682-A1 Method and Means for the Treatment of Cachexia BIONERIS AB 2010-10-14 US disclosed
US-20090175924-A1 COATED STENT BIONERIS AB (SE) 2009-07-09 US disclosed
EP-1390045-B1 THE USE OF A COMPOUND WITH A NEGATIVELY CHARGED DOMAIN OF PHOSPHOROUS-CONTAINING RADICALS FOR THE TREATMENT OF RESTENOSIS BIONERIS AB (SE) 2008-12-03 EP disclosed
US-20050261756-A1 Coated stent BIONERIS AB (SE) 2005-11-24 US disclosed
US-6949517-B1 Method of treating inflammatory, tissue repair and infectious conditions SIREN MATTI 2005-09-27 US disclosed
EP-1545643-A1 COATED STENT Bioneris AB, (SE) 2005-06-29 EP disclosed
US-20040235799-A1 Use of a compound with a negatively charged domain of radicals for the treatment of restenosis BIONERIS AB (SE) 2004-11-25 US disclosed
WO-2004022123-A1 COATED STENT BIONERIS AB (SE) 2004-03-18 WO disclosed
EP-1390045-A1 THE USE OF A COMPOUND WITH A NEGATIVELY CHARGED DOMAIN OF RADICALS FOR THE TREATMENT OF RESTENOSIS Bioneris AB, c/o Ekonomikonsult Islinge KB (SE) 2004-02-25 EP disclosed
EP-0910383-B1 THE USE OF GROWTH FACTOR MODULATING COMPOUNDS BIONERIS AB (SE) 2003-10-15 EP disclosed
US-6632797-B2 Administering to a mammal a cyclic compound (acyclic, carbocyclic or heterocyclic) substituted by at least three vicinal phosphorus containing radicals for treating angiogenesis in tumor conditions SIREN MATTI (FI) 2003-10-14 US disclosed
WO-2002096436-A1 THE USE OF A COMPOUND WITH A NEGATIVELY CHARGED DOMAIN OF RADICALS FOR THE TREATMENT OF RESTENOSIS BIONERIS AB (SE) 2002-12-05 WO disclosed
EP-1216705-A2 The use of growth factor modulation compounds substituted with three vicinal phosphorus containing radical in the manufacture of a medicament for tissue repair PERSTORP AB (SE) 2002-06-26 EP disclosed
US-20020065253-A1 Use of growth factor modulating compounds SIREN MATTI (FI) 2002-05-30 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 (5 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-20100261682-A1 Method and Means for the Treatment of Cachexia PYGM, GYS1, CPT1B OPRM1 53/4885OPRD1 103/4885HTR2A 2407/4885
US-20020065253-A1 Use of growth factor modulating compounds HDGF, PGF, FGF2 OPRM1 990/4885OPRD1 1988/4885HTR2A 1137/4885
US-20160074421-A1 METHOD FOR THE TREATMENT OF DISEASES CAUSED BY HAEMORRHAGIC VIRUSES AND COMPOUNDS FOR USE IN SAID TREATMENT TTPA, LPO, HADHB OPRM1 498/4885OPRD1 722/4885HTR2A 3912/4885
US-20040235799-A1 Use of a compound with a negatively charged domain of radicals for the treatment of restenosis PCNA, OPRK1, OGFR OPRM1 32/4885OPRD1 11/4885HTR2A 2575/4885
US-20090175924-A1 COATED STENT PHOSPHO1, SOST, PLCB3 OPRM1 68/4885OPRD1 28/4885HTR2A 2961/4885

“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.