SCHEMBL2678636

SCHEMBL2678636

N=C(NO)c1ccc(Oc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])c1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
PDE7A Q13946 1/20 0.46
EPAS1 Q99814 1/20 0.46
LMNA P02545 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 2/20 0.44
HPSE Q9Y251 1/20 0.44
PRSS1 P07477 4/20 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
SCHEMBL5607733 0.83 LMNA (0.52) KMT2AMEN1PDE7ALMNASMN1; SMN2
SCHEMBL2821186 0.82 HPSE (0.56) KMT2AMEN1PDE7AEPAS1LMNA
SCHEMBL2821818 0.81 LMNA (0.67) KMT2AMEN1PDE7AEPAS1LMNA
SCHEMBL4398948 0.79 ALDH1A1 (0.57) KMT2AMEN1LMNASMN1; SMN2POLB
SCHEMBL2678638 0.78 LMNA (0.51) KMT2AMEN1PDE7AEPAS1LMNA
SCHEMBL2678631 0.78 LMNA (0.51) KMT2AMEN1PDE7AEPAS1LMNA
SCHEMBL5607423 0.78 MAPT (0.45) KMT2AMEN1LMNASMN1; SMN2POLB
SCHEMBL4402565 0.77 VCAM1 (0.63) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL641210 0.72 HPGD (0.63) KMT2AMEN1PDE7AEPAS1LMNA
SCHEMBL2826350 0.71 MERTK (0.60) KMT2AMEN1PDE7AEPAS1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8175860-B2 Method of inhibiting the growth of Helicobacter pylori NATIONAL TSING HUA UNIVERSITY (TW) 2012-05-08 US disclosed
US-20100305152-A1 METHOD OF INHIBITING THE GROWTH OF HELICOBACTER PYLORI NATIONAL TSING HUA UNIVERSITY (TW) 2010-12-02 US 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-20100305152-A1 METHOD OF INHIBITING THE GROWTH OF HELICOBACTER PYLORI HPD, HAAO, HK1 KMT2A 2315/4885MEN1 2935/4885PDE7A 4318/4885

“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.