SCHEMBL4236476

SCHEMBL4236476

Cc1cc(N)ccc1Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.62
KMT2A Q03164 5/20 0.62
MEN1 O00255 3/20 0.62
MAPT P10636 2/20 0.62
PDE7A Q13946 2/20 0.61
HSPB1 P04792 3/20 0.52
HTT P42858 2/20 0.50
CYP3A4 P08684 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
TSHR P16473 2/20 0.46
RECQL P46063 1/20 0.46
PKM P14618 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
SCHEMBL4238016 0.91 KMT2A (0.71) ALDH1A1KMT2AMEN1MAPTPDE7A
SCHEMBL9320395 0.88 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1MAPTPDE7A
SCHEMBL5240730 0.84 HSPB1 (0.55) ALDH1A1KMT2AMEN1MAPTPDE7A
SCHEMBL4687037 0.84 ALDH1A1 (0.61) ALDH1A1KMT2AMEN1MAPTPDE7A
SCHEMBL4237867 0.84 ALDH1A1 (0.61) ALDH1A1KMT2AMEN1MAPTPDE7A
SCHEMBL2992329 0.83 ALDH1A1 (0.52) ALDH1A1KMT2AMEN1MAPTCYP3A4
SCHEMBL27438045 0.83 TLR9 (0.55) ALDH1A1KMT2AMEN1MAPTPDE7A
SCHEMBL4238110 0.82 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1MAPTPDE7A
SCHEMBL9321063 0.82 ALDH1A1 (0.67) ALDH1A1KMT2AMEN1MAPTPDE7A
SCHEMBL5148186 0.82 ALDH1A1 (0.56) ALDH1A1KMT2AMEN1MAPTPDE7A

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 ALDH1A1 4542/4885KMT2A 3436/4885MEN1 2447/4885

“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.