SCHEMBL14115752

SCHEMBL14115752

NC1CCN(C(=O)CC2CCCC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.47
GNAO1 P09471 1/20 0.47
GNAI1 P63096 1/20 0.47
TPSAB1 Q15661 1/20 0.46
TPSD1 Q9BZJ3 1/20 0.46
TPSG1 Q9NRR2 1/20 0.46
DPP4 P27487 1/20 0.45
NAMPT P43490 1/20 0.45
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
HSD17B10 Q99714 1/20 0.44
CACNA1B Q00975 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
FAAH O00519 1/20 0.41
TP53 P04637 1/20 0.41
CNR2 P34972 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD11B1 P28845 1/20 0.39

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
SCHEMBL3704195 0.84 NAMPT (0.50) TPSAB1TPSD1TPSG1NAMPTALDH1A1
SCHEMBL8337295 0.83 TPSAB1 (0.48) TPSAB1TPSD1TPSG1DPP4NAMPT
SCHEMBL12398 0.82 KDM4E (0.51) NAMPTALDH1A1KDM4EHSD17B10TP53
SCHEMBL3700457 0.82 KDM4E (0.51) NAMPTALDH1A1KDM4EHSD17B10TP53
SCHEMBL3698852 0.82 ALDH1A1 (0.51) NAMPTALDH1A1KDM4EHSD17B10FAAH
SCHEMBL3706069 0.82 KDM4E (0.51) NAMPTALDH1A1KDM4EHSD17B10TP53
SCHEMBL17551535 0.81 TPSAB1 (0.47) TPSAB1TPSD1TPSG1DPP4NAMPT
SCHEMBL8258158 0.81 ALDH1A1 (0.58) TPSAB1TPSD1TPSG1NAMPTALDH1A1
SCHEMBL22657675 0.81 NAMPT (0.45) TPSAB1TPSD1TPSG1DPP4NAMPT
SCHEMBL2439450 0.79 GNAI3 (0.53) GNAI3GNAO1GNAI1DPP4NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors GLAXO GROUP LIMITED 2008-07-24 US disclosed
US-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors GLAXO GROUP LIMITED 2008-07-24 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-20080175914-A1 Pyrazolo[3,4-b]Pyridine Compounds, and their Use as Phosphodiesterase Inhibitors PDE5A, PDE3B, PDE4A GNAI3 603/4885GNAO1 134/4885GNAI1 539/4885

“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.