SCHEMBL16079734

SCHEMBL16079734

Nc1ncnc2c1nc(Br)n2[C@@H]1OC2COP(=O)(O)O[C@H]2[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 13/20 1.00
▸ PDE4B Q07343 13/20 1.00
▸ PDE4C Q08493 13/20 1.00
▸ PDE4D Q08499 13/20 1.00
▸ LMNA P02545 2/20 0.81
▸ RAPGEF3 O95398 1/20 0.81
▸ TSHR P16473 1/20 0.81
▸ HIF1A Q16665 1/20 0.81
▸ MAPT P10636 1/20 0.81
▸ PMP22 Q01453 1/20 0.81
▸ NPSR1 Q6W5P4 1/20 0.81
▸ PRKACA P17612 1/20 0.70
▸ PRKACG P22612 1/20 0.70
▸ PRKACB P22694 1/20 0.70
▸ STING1 Q86WV6 2/20 0.68

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
SCHEMBL2713659 1.00 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL29384358 1.00 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL5951342 1.00 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL29359388 1.00 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL13300468 1.00 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL9702440 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL13300472 0.90 PDE4A (0.81) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL15906331 0.90 PDE4A (0.81) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL29381703 0.90 RAPGEF3 (1.00) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL1106661 0.90 PDE4A (0.81) PDE4APDE4BPDE4CPDE4DLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140271584-A1 Methods and Compositions for Direct Reprogramming of Somatic Cells to Stem Cells, and Uses of these Cells THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2014-09-18 — — 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-20140271584-A1 Methods and Compositions for Direct Reprogramming of Somatic Cells to Stem Cells, and Uses of these Cells NOTCH1, NOTCH4, NOTCH2 PDE4A 4786/4885PDE4B 4812/4885PDE4C 4692/4885

“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.

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