SCHEMBL26693461

SCHEMBL26693461

O=[N+]([O-])c1ccccc1-c1cc2nc(-c3ccccc3)n(-c3ccccc3)c2c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.50
▸ HTT P42858 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ MEN1 O00255 5/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ GAA P10253 2/20 0.44
▸ MAPT P10636 4/20 0.42
▸ GUSB P08236 1/20 0.42
▸ F2 P00734 1/20 0.42
▸ C1R P00736 1/20 0.42
▸ SIRT2 Q8IXJ6 1/20 0.41
▸ HPGD P15428 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ KLK3 P07288 1/20 0.38

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
SCHEMBL29959680 1.00 ALDH1A1 (0.50) ALDH1A1HTTTDP1POLBMEN1
SCHEMBL15797192 0.81 ALDH1A1 (0.45) ALDH1A1HTTTDP1POLBMEN1
SCHEMBL15430958 0.79 ALDH1A1 (0.50) ALDH1A1HTTTDP1POLBMEN1
SCHEMBL15430959 0.78 ALDH1A1 (0.49) ALDH1A1HTTTDP1POLBMEN1
SCHEMBL18347067 0.77 ALDH1A1 (0.54) ALDH1A1HTTTDP1POLBMEN1
SCHEMBL15796899 0.76 ALDH1A1 (0.45) ALDH1A1HTTTDP1POLBMEN1
SCHEMBL21155436 0.76 ALDH1A1 (0.39) ALDH1A1HTTTDP1POLBMEN1
SCHEMBL21155155 0.76 ALDH1A1 (0.43) ALDH1A1HTTTDP1MEN1KMT2A
SCHEMBL2957388 0.76 MEN1 (0.42) ALDH1A1HTTTDP1MEN1KMT2A
SCHEMBL15796882 0.76 ALDH1A1 (0.44) ALDH1A1HTTTDP1POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250098532-A1 NITROGENOUS COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2025-03-20 — — US disclosed
EP-4281455-A1 NITROGENOUS COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2023-11-29 — — EP disclosed
CN-116710454-A Nitrogen-containing compounds for organic electroluminescent devices 默克专利有限公司 2023-09-05 — — CN disclosed
WO-2022157343-A1 NITROGENOUS COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-07-28 — — WO 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-20250098532-A1 NITROGENOUS COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES NCL, NES, NPM1 ALDH1A1 2452/4885HTT 1232/4885TDP1 2490/4885

“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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