SCHEMBL24711485

SCHEMBL24711485

COc1ccc(-c2nc3cc(C(C)C)ccc3o2)cc1NC(=O)c1cccc([N+](=O)[O-])c1C

nearest known ligand 0.88

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.88
▸ TP53 P04637 7/20 0.64
▸ NPSR1 Q6W5P4 2/20 0.64
▸ MEN1 O00255 1/20 0.64
▸ USP2 O75604 1/20 0.64
▸ ALDH1A1 P00352 1/20 0.64
▸ LMNA P02545 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ HSD17B10 Q99714 1/20 0.64
▸ THRB P10828 2/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.58
▸ BLM P54132 1/20 0.58
▸ RAB9A P51151 1/20 0.52
▸ PTGS2 P35354 4/20 0.50
▸ POLB P06746 1/20 0.49

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
SCHEMBL24711239 0.86 MAPT (0.75) MAPTTP53NPSR1MEN1USP2
SCHEMBL24710830 0.82 MAPT (0.71) MAPTTP53NPSR1MEN1USP2
SCHEMBL24710982 0.81 TP53 (0.75) MAPTTP53NPSR1MEN1USP2
SCHEMBL24711515 0.74 TP53 (0.80) MAPTTP53NPSR1MEN1USP2
SCHEMBL24710798 0.73 MAPT (0.58) MAPTTP53MEN1USP2ALDH1A1
SCHEMBL24711202 0.72 MAPT (0.66) MAPTTP53NPSR1MEN1USP2
SCHEMBL24711492 0.72 MAPT (0.66) MAPTTP53NPSR1MEN1ALDH1A1
SCHEMBL24711762 0.72 MAPT (0.67) MAPTTP53NPSR1MEN1ALDH1A1
SCHEMBL2624627 0.71 MAPT (0.71) MAPTTP53NPSR1MEN1USP2
SCHEMBL24711498 0.71 MAPT (0.73) MAPTTP53NPSR1MEN1USP2

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-20220395500-A1 SMALL MOLECULE ACTIVATORS OF INTERFERON REGULATORY FACTOR 3 AND METHODS OF USE THEREOF NEURALEXO, INC. 2022-12-15 — — 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-20220395500-A1 SMALL MOLECULE ACTIVATORS OF INTERFERON REGULATORY FACTOR 3 AND METHODS OF USE THEREOF IRF3, IRF2BP2, STAT1 MAPT 4038/4885TP53 673/4885NPSR1 4483/4885

“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.

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