SCHEMBL25071663

SCHEMBL25071663

CCC(=O)N[C@H](CCc1ccc([N+](=O)[O-])cc1)C(=O)OC

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 2/20 0.45
KCNJ1 P48048 1/20 0.45
KCNH2 Q12809 1/20 0.45
MAPT P10636 2/20 0.44
RAB9A P51151 1/20 0.44
CTSL P07711 2/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 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
SCHEMBL22304086 0.87 MEN1 (0.49) KMT2AMEN1
SCHEMBL22338701 0.87 MEN1 (0.49) KMT2AMEN1
SCHEMBL7258072 0.79 KMT2A (0.51) KMT2AMEN1ALDH1A1KCNJ1KCNH2
SCHEMBL2603379 0.78 TSHR (0.49) KMT2AMEN1ALDH1A1KCNJ1KCNH2
SCHEMBL5692057 0.78 ALDH1A1 (0.50) KMT2AMEN1ALDH1A1MAPTRAB9A
SCHEMBL22285567 0.76 CA2 (0.58) KMT2AMEN1ALDH1A1MAPTRAB9A
SCHEMBL22285568 0.76 CA2 (0.58) KMT2AMEN1ALDH1A1MAPTRAB9A
SCHEMBL7060664 0.76 TSHR (0.47) KMT2AMEN1ALDH1A1KCNJ1KCNH2
SCHEMBL18569695 0.75 MEN1 (0.47) KMT2AMEN1
SCHEMBL19762722 0.74 ALDH1A1 (0.47) KMT2AMEN1ALDH1A1MAPTRAB9A

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-20230053746-A1 IL-17 LIGANDS AND USES THEREOF DICE MOLECULES SV, INC. 2023-02-23 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-20230053746-A1 IL-17 LIGANDS AND USES THEREOF IL17A, IL2, IL15 KMT2A 4343/4885MEN1 2700/4885ALDH1A1 951/4885

“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.