SCHEMBL5653191

SCHEMBL5653191

O=C1CCC(=O)N1c1ccc([N+](=O)[O-])cc1F

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.64
KMT2A Q03164 5/20 0.64
POLB P06746 3/20 0.60
CASP6 P55212 2/20 0.60
APEX1 P27695 1/20 0.60
CTDSP1 Q9GZU7 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
LMNA P02545 3/20 0.51
PARL Q9H300 1/20 0.47
MAPT P10636 4/20 0.46
THRB P10828 1/20 0.46
HIF1A Q16665 1/20 0.46
MEN1 O00255 4/20 0.44
GAA P10253 3/20 0.44
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
CCKBR P32239 1/20 0.43
GABRA3 P34903 1/20 0.43

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
SCHEMBL6141764 0.82 TDP1 (0.61) ALDH1A1KMT2APOLBCASP6APEX1
SCHEMBL6141689 0.81 POLB (0.60) ALDH1A1KMT2APOLBCASP6APEX1
SCHEMBL6140569 0.81 TDP1 (0.60) ALDH1A1KMT2APOLBCASP6APEX1
SCHEMBL6140662 0.81 CASP6 (0.60) ALDH1A1KMT2APOLBCASP6APEX1
SCHEMBL6140611 0.80 POLB (0.56) ALDH1A1KMT2APOLBCASP6APEX1
SCHEMBL78723 0.79 ALDH1A1 (0.62) ALDH1A1KMT2APOLBCASP6APEX1
SCHEMBL3042630 0.78 ALDH1A1 (1.00) ALDH1A1KMT2APOLBLMNAMAPT
SCHEMBL29744710 0.78 ALDH1A1 (1.00) ALDH1A1KMT2APOLBLMNAMAPT
SCHEMBL5924422 0.78 SCN2A (0.58) ALDH1A1KMT2ACASP6CTDSP1LMNA
SCHEMBL14464189 0.78 ALDH1A1 (0.79) ALDH1A1KMT2APOLBLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070213355-A1 1H-Imidazo[4,5-C]Quinoline Derivatives in the Treatment of Protein Kinase Dependent Diseases CAPRARO HANS-GEORG 2007-09-13 US disclosed
EP-1689747-A1 1H-IMIDAZO [4,5-C] QUINOLINE DERIVATIVES IN THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES Novartis AG (CH) 2006-08-16 EP disclosed
WO-2005054238-A1 1H-IMIDAZO[4,5-C]QUINOLINE DERIVATIVES IN THE TREATMENT OF PROTEIN KINASE DEPENDENT DISEASES NOVARTIS AG (CH) 2005-06-16 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-20070213355-A1 1H-Imidazo[4,5-C]Quinoline Derivatives in the Treatment of Protein Kinase Dependent Diseases ABL1, PRKCA, PRKCQ ALDH1A1 2948/4885KMT2A 760/4885POLB 2837/4885

“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.