SCHEMBL16094480

SCHEMBL16094480

CCCNc1nc(N(CC)CC)nc2c(NCCC)nc(NC)nc12

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 10/20 0.57
TDP1 Q9NUW8 2/20 0.36
GAA P10253 1/20 0.36
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
TLR7 Q9NYK1 1/20 0.31
APP P05067 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
TSHR P16473 1/20 0.31
PRUNE1 Q86TP1 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
Hydrochloric Acid SCHEMBL17494517 0.98 SLC29A1 (0.56) SLC29A1TDP1GAACA1CA2
SCHEMBL16094045 0.88 SLC29A1 (0.57) SLC29A1TDP1GAACA1CA2
SCHEMBL16094465 0.86 SLC29A1 (0.51) SLC29A1CA1CA2CA9PDE4A
SCHEMBL16094312 0.85 SLC29A1 (0.51) SLC29A1PDE4ATLR7APPBCHE
Hydrochloric Acid SCHEMBL16094322 0.85 SLC29A1 (0.50) SLC29A1PDE4ATLR7APPBCHE
Hydrochloric Acid SCHEMBL17494536 0.84 SLC29A1 (0.50) SLC29A1TLR7APPBCHEACHE
SCHEMBL16095016 0.81 SLC29A1 (0.47) SLC29A1PRUNE1
Hydrochloric Acid SCHEMBL17494511 0.80 SLC29A1 (0.46) SLC29A1PRUNE1
SCHEMBL20164443 0.78 SLC29A1 (0.66) SLC29A1GAATLR7APPBCHE
SCHEMBL18826169 0.76 SLC29A1 (0.44) SLC29A1CA1CA2CA9TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9643971-B2 Breathing control modulating compounds, and methods of using same GALLEON PHARMACEUTICALS, INC. (US) 2017-05-09 US claimed
US-20160046635-A1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME GALLEON PHARMACEUTICALS, INC. 2016-02-18 US claimed
EP-2968329-A1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME Galleon Pharmaceuticals, Inc. (US) 2016-01-20 EP claimed
WO-2014151462-A1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME GALLEON PHARMACEUTICALS, INC. (US) 2014-09-25 WO claimed
US-9643971-B2 Breathing control modulating compounds, and methods of using same GALLEON PHARMACEUTICALS, INC. (US) 2017-05-09 US disclosed
US-20160046635-A1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME GALLEON PHARMACEUTICALS, INC. 2016-02-18 US disclosed
EP-2968329-A1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME Galleon Pharmaceuticals, Inc. (US) 2016-01-20 EP disclosed
WO-2014151462-A1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME GALLEON PHARMACEUTICALS, INC. (US) 2014-09-25 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-20160046635-A1 NOVEL BREATHING CONTROL MODULATING COMPOUNDS, AND METHODS OF USING SAME PRDX5, QDPR, P2RX5 SLC29A1 1696/4885TDP1 1040/4885GAA 1650/4885

“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.