SCHEMBL21990729

SCHEMBL21990729

[O-][n+]1[c]nc(-c2cccc[n+]2[O-])cc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8755109 0.71 LMNA (0.40) LMNAHTTKMT2AL3MBTL1
SCHEMBL31509682 0.71 LMNA (0.40) LMNAHTTKMT2AL3MBTL1
SCHEMBL29727517 0.71 LMNA (0.52) LMNAHTTKMT2AL3MBTL1
SCHEMBL871319 0.71 LMNA (0.52) LMNAHTTKMT2AL3MBTL1
SCHEMBL3953874 0.70 LMNA (0.33) LMNAHTT
SCHEMBL30305663 0.68 KDM4E (0.50) LMNAHTTL3MBTL1
SCHEMBL1367753 0.68 KDM4E (0.50) LMNAHTTL3MBTL1
SCHEMBL27684655 0.67 LMNA (0.48) LMNAHTTKMT2AL3MBTL1
SCHEMBL4635144 0.66 LMNA (0.43) LMNAHTTKMT2AL3MBTL1
SCHEMBL28762856 0.64 METAP2 (0.38) LMNAHTT

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-10889553-B2 Asymmetric triazole benzamide derivatives and the compositions and methods of treatment regarding the same NYSNOBIO IRELAND DAC (IE) 2021-01-12 US disclosed
US-20200172497-A1 ASYMMETRIC TRIAZOLE BENZAMIDE DERIVATIVES AND THE COMPOSITIONS AND METHODS OF TREATMENT REGARDING THE SAME NYSNOBIO IRELAND DAC (IE) 2020-06-04 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 (2 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-20200172497-A1 ASYMMETRIC TRIAZOLE BENZAMIDE DERIVATIVES AND THE COMPOSITIONS AND METHODS OF TREATMENT REGARDING THE SAME ATG7, PINK1, ADRM1 LMNA 1956/4885HTT 2008/4885KMT2A 795/4885
US-10889553-B2 Asymmetric triazole benzamide derivatives and the compositions and methods of treatment regarding the same ATG7, PINK1, ADRM1 LMNA 1956/4885HTT 2008/4885KMT2A 795/4885

“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.