SCHEMBL1001272

SCHEMBL1001272

OC[C@H]1O[C@@H](n2cnc3ccccc32)[C@H](O)[C@@H]1O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.56
ADORA2A P29274 1/20 0.56
MAPT P10636 2/20 0.52
CDA P32320 1/20 0.52
ALDH1A1 P00352 3/20 0.52
HTT P42858 3/20 0.52
LMNA P02545 3/20 0.52
TP53 P04637 2/20 0.52
BLM P54132 2/20 0.52
RAB9A P51151 2/20 0.52
PMP22 Q01453 2/20 0.52
GMNN O75496 1/20 0.52
NFKB1 P19838 1/20 0.52
DNMT1 P26358 1/20 0.52
THPO P40225 1/20 0.52
MTOR P42345 1/20 0.52
HBB P68871 1/20 0.52
KDM4E B2RXH2 3/20 0.52
PKM P14618 1/20 0.52
SMN1; SMN2 Q16637 2/20 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
SCHEMBL30195858 1.00 ADORA3 (0.56) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL8047049 1.00 ADORA3 (0.56) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL8371824 1.00 ADORA3 (0.56) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL1319619 1.00 ADORA3 (0.56) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL8368934 1.00 ADORA3 (0.56) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL31265252 1.00 ADORA3 (0.56) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL4215253 0.99 ADORA3 (0.55) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL6305941 0.83 KDM4E (0.52) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL4310230 0.83 KDM4E (0.52) ADORA3ADORA2AMAPTCDAALDH1A1
SCHEMBL11123748 0.83 KDM4E (0.52) ADORA3ADORA2AMAPTCDAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111372451-A Compositions for hemolysis and coagulation regulation and stabilization of extracellular vesicles 斯特雷克股份有限公司 2020-07-03 CN claimed
US-20010047038-A1 Method of using (H+/K+) ATPase inhibitors as antiviral agents MOORMAN ALAN E (US) 2001-11-29 US claimed
US-5945425-A ADENOSINE TRIPHOSPHASE INHIBITOR; DNA VIRICIDE G.D. SEARLE & CO. (US) 1999-08-31 US claimed
WO-1995029897-A1 METHOD OF USING (H+/K+) ATPase INHIBITORS AS ANTIVIRAL AGENTS G.D. SEARLE & CO. (US) 1995-11-09 WO claimed
CN-111372451-A Compositions for hemolysis and coagulation regulation and stabilization of extracellular vesicles 斯特雷克股份有限公司 2020-07-03 CN disclosed
WO-2016205566-A1 FZD7 SPECIFIC ANTIBODIES AND VACCINES TO TREAT CANCER AND CONTROL STEM CELL FUNCTION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-12-22 WO disclosed
EP-1698635-B1 BENZIMIDAZOLE DERIVATIVES AND MEDICAL USES THEREOF KISSEI PHARMACEUTICAL (JP) 2011-12-14 EP disclosed
EP-2276479-A2 PRODRUGS OF NEURAMINIDASE INHIBITORS TSRL, Inc. (US) 2011-01-26 EP disclosed
WO-2009129305-A2 PRODRUGS OF NEURAMINIDASE INHIBITORS TSRL, INC. (US) 2009-10-22 WO disclosed
EP-1482916-A4 SCHWANN CELL AND PHOSPHODIESTERASE INHIBITORS BASED THERAPY UNIV MIAMI (US) 2007-12-12 EP disclosed
US-6906078-B2 Method of using (H+/K+) ATPase inhibitors as antiviral agents PHARMACIA CORPORATION (US) 2005-06-14 US disclosed
EP-1482916-A2 SCHWANN CELL AND PHOSPHODIESTERASE INHIBITORS BASED THERAPY University of Miami (US) 2004-12-08 EP disclosed
WO-2003065994-A2 SCHWANN CELL AND PHOSPHODIESTERASE INHIBITORS BASED THERAPY UNIVERSITY OF MIAMI (US) 2003-08-14 WO disclosed
US-20010047038-A1 Method of using (H+/K+) ATPase inhibitors as antiviral agents MOORMAN ALAN E (US) 2001-11-29 US disclosed
US-5945425-A ADENOSINE TRIPHOSPHASE INHIBITOR; DNA VIRICIDE G.D. SEARLE & CO. (US) 1999-08-31 US disclosed
WO-1997027205-A1 IMIDAZO[1,2-A]PYRIDINE C-NUCLEOSIDES AS ANTIVIRAL AGENTS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1997-07-31 WO disclosed
WO-1995029897-A1 METHOD OF USING (H+/K+) ATPase INHIBITORS AS ANTIVIRAL AGENTS G.D. SEARLE & CO. (US) 1995-11-09 WO 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-20010047038-A1 Method of using (H+/K+) ATPase inhibitors as antiviral agents ATP4A, ATP1A1, ATP1A4 ADORA3 257/4885ADORA2A 742/4885MAPT 4881/4885

“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.