SCHEMBL1887396

SCHEMBL1887396

COC(=O)c1ccc(CN2CCCC2)cc1[N+](=O)[O-]

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.52
MAPT P10636 3/20 0.52
MAPK1 P28482 3/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ALDH1A1 P00352 5/20 0.50
LMNA P02545 1/20 0.50
TDP1 Q9NUW8 1/20 0.49
KDM4E B2RXH2 3/20 0.47
PKM P14618 1/20 0.47
POLB P06746 1/20 0.47
SIRT6 Q8N6T7 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL590915 0.99 L3MBTL1 (0.53) L3MBTL1MAPTMAPK1NPSR1ALDH1A1
SCHEMBL13634150 0.90 SIRT6 (0.55) L3MBTL1MAPTMAPK1NPSR1ALDH1A1
SCHEMBL7298034 0.89 ALDH1A1 (0.51) MAPTMAPK1ALDH1A1LMNAKMT2A
SCHEMBL495726 0.89 SIRT6 (0.54) L3MBTL1MAPTMAPK1NPSR1ALDH1A1
SCHEMBL1890184 0.84 L3MBTL1 (0.53) L3MBTL1MAPTMAPK1NPSR1ALDH1A1
Hydrochloric Acid SCHEMBL3513321 0.83 L3MBTL1 (0.52) L3MBTL1MAPTMAPK1NPSR1ALDH1A1
SCHEMBL28784218 0.83 L3MBTL1 (0.54) L3MBTL1MAPTMAPK1NPSR1ALDH1A1
Hydrochloric Acid SCHEMBL1884847 0.83 L3MBTL1 (0.52) L3MBTL1MAPTMAPK1NPSR1ALDH1A1
SCHEMBL5537869 0.82 SIRT6 (0.42) L3MBTL1MAPTMAPK1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL3510778 0.82 L3MBTL1 (0.53) L3MBTL1MAPTMAPK1NPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8173659-B2 Substituted pyrazolo[4,3-C]pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-05-08 US disclosed
US-20110230470-A1 SUBSTITUTED PYRAZOLO[4,3-C]PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-09-22 US disclosed
US-7947686-B2 Substituted pyrazolo[4,3-c]pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-05-24 US disclosed
US-20090023745-A1 Substituted Pyrazolo[4,3-c]Pyridine Derivatives Active as Kinase Inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2009-01-22 US disclosed
EP-1968976-A1 SUBSTITUTED PYRAZOLO [4,3-C] PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-09-17 EP disclosed
WO-2007068619-A1 SUBSTITUTED PYRAZOLO [4,3-C] PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2007-06-21 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 (2 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-20110230470-A1 SUBSTITUTED PYRAZOLO[4,3-C]PYRIDINE DERIVATIVES ACTIVE AS KINASE INHIBITORS MAP3K3, MAP3K1, MAP3K19 L3MBTL1 3525/4885MAPT 2600/4885MAPK1 49/4885
US-20090023745-A1 Substituted Pyrazolo[4,3-c]Pyridine Derivatives Active as Kinase Inhibitors MAP3K3, MAP3K1, MAP3K19 L3MBTL1 3525/4885MAPT 2600/4885MAPK1 49/4885

“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.