SCHEMBL25401554

SCHEMBL25401554

NCCCC(Nc1ccc([N+](=O)[O-])c2nonc12)C(=O)NCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
USP2 O75604 1/20 0.57
HTT P42858 1/20 0.57
RECQL P46063 1/20 0.57
MYC P01106 10/20 0.47
IDO1 P14902 2/20 0.47
MIF P14174 1/20 0.45
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAX P61244 5/20 0.43
GSTM2 P28161 2/20 0.43
GSTP1 P09211 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
SCHEMBL25401535 1.00 MEN1 (0.57) MEN1KMT2AUSP2HTTRECQL
Hydrochloric Acid SCHEMBL25405669 0.99 MEN1 (0.56) MEN1KMT2AUSP2HTTRECQL
Hydrochloric Acid SCHEMBL25405658 0.99 MEN1 (0.56) MEN1KMT2AUSP2HTTRECQL
SCHEMBL26269621 0.91 IDO1 (0.48) MEN1KMT2AUSP2HTTRECQL
SCHEMBL25435033 0.88 MEN1 (0.53) MEN1KMT2AUSP2HTTRECQL
SCHEMBL25435035 0.88 MEN1 (0.53) MEN1KMT2AUSP2HTTRECQL
SCHEMBL26269121 0.85 MEN1 (0.51) MEN1KMT2AUSP2HTTRECQL
SCHEMBL26268722 0.85 MEN1 (0.52) MEN1KMT2AUSP2HTTRECQL
SCHEMBL26268792 0.83 MEN1 (0.57) MEN1KMT2AUSP2HTTRECQL
SCHEMBL11036403 0.83 MYC (0.50) MEN1KMT2AUSP2HTTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230270889-A1 Fluorescently-Traceable Amino Acid Derivative And Preparation Methods And Use Thereof Capital Medical University (CN) 2023-08-31 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-20230270889-A1 Fluorescently-Traceable Amino Acid Derivative And Preparation Methods And Use Thereof SLC7A5, BCAT2, BCAT1 MEN1 4025/4885KMT2A 3420/4885USP2 2878/4885

“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.