SCHEMBL29601516

SCHEMBL29601516

O=[N+]([O-])c1cccc([I+]c2cccc([N+](=O)[O-])c2)c1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.67
LMNA P02545 3/20 0.67
ALDH1A1 P00352 6/20 0.55
ACHE P22303 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
ALOX15 P16050 1/20 0.55
HSP90AA1 P07900 1/20 0.53
GAA P10253 1/20 0.52
HTT P42858 1/20 0.52
KMT2A Q03164 1/20 0.52
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
TP53 P04637 1/20 0.50
NFE2L2 Q16236 1/20 0.48
CA2 P00918 1/20 0.48
CA5A P35218 1/20 0.48

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
SCHEMBL143162 1.00 TSHR (0.67) TSHRLMNAALDH1A1ACHETDP1
Bromide SCHEMBL31058252 0.98 TSHR (0.64) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL31145718 0.98 TSHR (0.64) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL425911 0.94 TSHR (0.59) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL31058260 0.92 TSHR (0.57) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL29457303 0.92 TSHR (0.57) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL8331595 0.92 TSHR (0.57) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL31058126 0.92 TSHR (0.57) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL143163 0.91 TSHR (0.55) TSHRLMNAALDH1A1ACHETDP1
SCHEMBL7583669 0.89 TSHR (0.53) TSHRLMNAALDH1A1ACHETDP1

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-20260044074-A1 ACCEPTOR-SUBSTITUTED EUV PAGS WITH HIGH ELECTRON AFFINITY MERCK PATENT GMBH (DE) 2026-02-12 US disclosed
WO-2024175523-A1 ACCEPTOR-SUBSTITUTED EUV PAGS WITH HIGH ELECTRON AFFINITY MERCK PATENT GMBH (DE) 2024-08-29 WO disclosed
CN-111050730-B Photoinitiator-modified polyacid polymers 登特斯普伊德特雷有限公司 2023-07-28 CN 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-20260044074-A1 ACCEPTOR-SUBSTITUTED EUV PAGS WITH HIGH ELECTRON AFFINITY ETV6, PAG1, ETV1 TSHR 368/4885LMNA 1130/4885ALDH1A1 3662/4885

“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.