SCHEMBL4236273

SCHEMBL4236273

Nc1ccc(Oc2ccc([N+](=O)[O-])cc2O)cc1F

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 5/20 0.51
ALDH1A1 P00352 3/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
PDE7A Q13946 1/20 0.49
GAA P10253 1/20 0.49
THRB P10828 1/20 0.49
TDP1 Q9NUW8 1/20 0.46
TTR P02766 1/20 0.45
HTT P42858 1/20 0.43
GPR35 Q9HC97 1/20 0.43
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL4233241 0.84 ALDH1A1 (0.54) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL4232662 0.83 HTT (0.60) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL4236328 0.82 HSPB1 (0.56) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL4233404 0.81 HSPB1 (0.64) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL4688745 0.80 MEN1 (0.47) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL4688753 0.80 MEN1 (0.47) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL30317900 0.78 HSPB1 (0.61) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL5549349 0.77 TTR (0.55) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL4232011 0.76 HSPB1 (0.39) HSPB1ALDH1A1KMT2AMEN1MAPT
SCHEMBL307768 0.75 TDP1 (0.61) ALDH1A1KMT2AMEN1MAPTGAA

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 US disclosed
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R HSPB1 3146/4885ALDH1A1 4542/4885KMT2A 3436/4885

“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.