SCHEMBL16429019

SCHEMBL16429019

[N-]=[N+]=Nc1ccc([N+](=O)[O-])c(COC2CC(=O)NC2=O)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 1/20 0.36
PNMT P11086 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 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
SCHEMBL21296443 0.78 MEN1 (0.41) GRIA2GABRA1GABRG2GABRB3GABRA5
SCHEMBL29425269 0.78 MEN1 (0.41) GRIA2GABRA1GABRG2GABRB3GABRA5
SCHEMBL10352631 0.77 ALDH1A1 (0.46)
SCHEMBL14249547 0.73 ALDH1A1 (0.40) GRIA2
SCHEMBL29278536 0.70 GRIA2 (0.37) GRIA2
Succinimide SCHEMBL28711840 0.65 DTYMK (0.43) GRIA2GABRA1GABRG2GABRB3GABRA5
SCHEMBL16002308 0.64 PDK1 (0.44) GRIA2
SCHEMBL20395675 0.63 MEN1 (0.54) GRIA2
SCHEMBL28234745 0.63 GRIA2 (0.44) GRIA2
SCHEMBL11232423 0.63 ALDH1A1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240091315-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX PHARMACEUTICALS, INC. 2024-03-21 US disclosed
US-20210322518-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX PHARMACEUTICALS, INC. 2021-10-21 US disclosed
US-10953073-B2 XTEN conjugate compositions and methods of making same AMUNIX PHARMACEUTICALS, INC. (US) 2021-03-23 US disclosed
WO-2020264132-A1 WOUND INSERTS FOR TREATMENT OF TUNNELING WOUNDS KCI LICENSING, INC. (US) 2020-12-30 WO disclosed
US-20190083577-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX PHARMACEUTICALS, INC. 2019-03-21 US disclosed
US-10172953-B2 XTEN conjugate compositions and methods of making same AMUNIX OPERATING INC. (US) 2019-01-08 US disclosed
US-20150037359-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME Amunix Operating, Inc. (US) 2015-02-05 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 (6 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-20150037359-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 GRIA2 3354/4885PNMT 3651/4885GABRA1 3351/4885
US-10172953-B2 XTEN conjugate compositions and methods of making same XPA, TXLNA, NGLY1 GRIA2 3354/4885PNMT 3651/4885GABRA1 3351/4885
US-20210322518-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 GRIA2 3354/4885PNMT 3651/4885GABRA1 3351/4885
US-10953073-B2 XTEN conjugate compositions and methods of making same XPA, TXLNA, NGLY1 GRIA2 3354/4885PNMT 3651/4885GABRA1 3351/4885
US-20190083577-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 GRIA2 3354/4885PNMT 3651/4885GABRA1 3351/4885
US-20240091315-A1 XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME XPA, TXLNA, NGLY1 GRIA2 3354/4885PNMT 3651/4885GABRA1 3351/4885

“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.