SCHEMBL28923016

SCHEMBL28923016

CNS(=O)(=O)NC(=O)c1c[n+](C)nc2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MEN1 O00255 5/20 0.35
▸ CACNA1B Q00975 1/20 0.35
▸ APBA1 Q02410 1/20 0.35
▸ PLK1 P53350 2/20 0.33
▸ MYC P01106 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ PABPC1 P11940 1/20 0.33
▸ EIF4H Q15056 1/20 0.33
▸ HTT P42858 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32

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
Iodide SCHEMBL22345512 0.99 KMT2A (0.35) KMT2AL3MBTL1MEN1CACNA1BAPBA1
SCHEMBL28641215 0.77 KDM4E (0.52) KMT2AL3MBTL1MEN1KDM4EUSP2
Sulfuric Acid SCHEMBL22345449 0.76 KDM4E (0.49) KMT2AL3MBTL1MEN1KDM4EUSP2
SCHEMBL22345590 0.76 CCR1 (0.43) KMT2AL3MBTL1MEN1PLK1KDM4E
SCHEMBL22345591 0.76 BBOX1 (0.44) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL22345593 0.76 BBOX1 (0.44) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
Iodide SCHEMBL22345354 0.75 BBOX1 (0.43) KMT2AMEN1KDM4ESMN1; SMN2
Iodide SCHEMBL22345583 0.75 BBOX1 (0.43) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
Iodide SCHEMBL22345356 0.75 BBOX1 (0.43) KMT2AMEN1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL22345448 0.71 DHODH (0.40) KMT2AMEN1KDM4ESMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220132847-A1 CINNOLINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH SYNGENTA CROP PROTECTION AG (CH) 2022-05-05 — — US disclosed
CN-113423694-A Cinnolinium compounds for use in a method for controlling unwanted plant growth 先正达农作物保护股份公司 2021-09-21 — — 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-20220132847-A1 CINNOLINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH NOTUM, DDT, CYP51A1 KMT2A 3742/4885L3MBTL1 3665/4885MEN1 603/4885

“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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