SCHEMBL589160

SCHEMBL589160

CN1CCCN(c2cc[c]c([N+](=O)[O-])c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
ALDH1A1 P00352 3/20 0.53
SIRT6 Q8N6T7 6/20 0.50
MAPT P10636 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.45
MAPK1 P28482 1/20 0.45
HTR6 P50406 3/20 0.43
HPGD P15428 1/20 0.43
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CHKA P35790 1/20 0.41

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
SCHEMBL589356 0.94 SIRT6 (0.55) LMNAALDH1A1SIRT6MAPTL3MBTL1
SCHEMBL28989562 0.87 MAPT (0.51) LMNAALDH1A1MAPTL3MBTL1MAPK1
SCHEMBL591314 0.83 MAPT (0.45) LMNAALDH1A1MAPTL3MBTL1HPGD
SCHEMBL28891048 0.79 CHRNA7 (0.45) LMNAALDH1A1MAPTL3MBTL1MAPK1
SCHEMBL6189229 0.78 MAPT (0.54) LMNAALDH1A1MAPTMAPK1HPGD
SCHEMBL589217 0.77 MAPT (0.38) ALDH1A1SIRT6MAPTMAPK1HPGD
SCHEMBL590403 0.77 ADRA2C (0.50) LMNAALDH1A1SIRT6MAPTMAPK1
SCHEMBL15474579 0.77 CHKA (0.45) LMNAALDH1A1MAPTMAPK1SMN1; SMN2
SCHEMBL6360154 0.76 LMNA (0.69) LMNAALDH1A1SIRT6MAPTL3MBTL1
SCHEMBL3569406 0.75 LMNA (1.00) LMNAALDH1A1SIRT6MAPTSMN1; SMN2

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
EP-2120932-B1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2014-07-09 EP disclosed
US-8114865-B2 Indazole derivatives as kinase inhibitors for the treatment of cancer NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-02-14 US disclosed
US-20100197665-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-08-05 US disclosed
EP-2120932-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Nerviano Medical Sciences S.r.l. (IT) 2009-11-25 EP disclosed
WO-2008074749-A9 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2009-05-07 WO disclosed
WO-2008074749-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-26 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-20100197665-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER MAP3K5, MAP3K19, MAP3K3 LMNA 3348/4885ALDH1A1 1771/4885SIRT6 2086/4885

“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.