SCHEMBL4948918

SCHEMBL4948918

CC(=O)C(O)[C@H]1O[C@@H](n2cnc3c(Cl)nc(Cl)nc32)[C@@](O)(C(C)=O)[C@@]1(O)C(C)=O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
TP53 P04637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ADORA2A P29274 7/20 0.40
NT5E P21589 6/20 0.38
ADORA3 P0DMS8 8/20 0.37
ADORA1 P30542 5/20 0.37
ADORA2B P29275 2/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL5498228 0.91 LMNA (0.37) LMNATP53ALDH1A1MAPTTDP1
SCHEMBL5492971 0.91 NT5E (0.38) LMNATP53ALDH1A1MAPTTDP1
SCHEMBL5735963 0.90 LMNA (0.35) LMNATP53ALDH1A1MAPTTDP1
SCHEMBL9404373 0.90 LMNA (0.35) LMNATP53ALDH1A1MAPTTDP1
SCHEMBL9404059 0.88 LMNA (0.34) LMNATP53ALDH1A1MAPTTDP1
SCHEMBL4834707 0.87 PDE4A (0.37) LMNAADORA2AADORA3ADORA1ADORA2B
SCHEMBL6386486 0.87 PDE4A (0.37) LMNAADORA2AADORA3ADORA1ADORA2B
SCHEMBL7066425 0.85 LMNA (0.42) LMNATP53ALDH1A1MAPTTDP1
SCHEMBL5498844 0.81 ADORA2A (0.44) LMNATP53ALDH1A1MAPTTDP1
SCHEMBL4950531 0.80 ADORA2A (0.34) LMNATP53ALDH1A1MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200405629-A1 PARENTERALLY ADMINISTERED IMMUNE ENHANCING DRUGS ARCUS BIOSCIENCES, INC. 2020-12-31 US disclosed
EP-2707483-B1 METHODS AND MATERIALS FOR NUCLEIC ACID MANIPULATION RWTH AACHEN UNIV (DE) 2017-10-18 EP disclosed
US-20120295311-A1 Methods and Materials for Nucleic Acid Manipulation BASF SE (DE) 2012-11-22 US disclosed
EP-1895841-A2 METHODS FOR SELECTIVE N-9 GLYCOSYLATION OF PURINES Brigham Young University (US) 2008-03-12 EP disclosed
WO-2006138396-A2 METHODS FOR SELECTIVE N-9 GLYCOSYLATION OF PURINES BRIGHAM YOUNG UNIVERSITY, TRANSFER TECHNOLOGY OFFICE (US) 2006-12-28 WO disclosed
EP-1090023-A1 2-(PURIN-9-YL)-TETRAHYDROFURAN-3,4-DIOL DERIVATIVES GLAXO GROUP LIMITED (GB) 2001-04-11 EP disclosed
WO-1999067264-A1 2-(PURIN-9-YL)-TETRAHYDROFURAN-3,4-DIOL DERIVATIVES GLAXO GROUP LIMITED (GB) 1999-12-29 WO disclosed
EP-0675896-A1 PURINE DERIVATIVES NOVO NORDISK A/S (DK) 1995-10-11 EP disclosed
WO-1994014832-A1 PURINE DERIVATIVES NOVO NORDISK A/S (DK) 1994-07-07 WO disclosed
EP-0603348-A1 PURINE DERIVATIVES NOVO NORDISK A/S (DK) 1994-06-29 EP disclosed
WO-1993023418-A1 PURINE DERIVATIVES NOVO NORDISK A/S (DK) 1993-11-25 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-20200405629-A1 PARENTERALLY ADMINISTERED IMMUNE ENHANCING DRUGS NT5C2, ADA, ENTPD1 LMNA 3844/4885TP53 2623/4885ALDH1A1 1616/4885

“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.