SCHEMBL17748346

SCHEMBL17748346

N=C(N)NCCCC(NC(=O)CNC(=O)C(N)CC(N)=O)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 6/20 0.43
▸ FNTA P49354 2/20 0.40
▸ FNTB P49356 2/20 0.40
▸ PGGT1B P53609 1/20 0.40
▸ C3AR1 Q16581 1/20 0.38
▸ FOLH1 Q04609 1/20 0.37
▸ NPY4R P50391 7/20 0.36
▸ NPY1R P25929 5/20 0.36
▸ NPY2R P49146 5/20 0.36
▸ NPY5R Q15761 5/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ GSTK1 Q9Y2Q3 1/20 0.36

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
SCHEMBL17748347 1.00 NOD1 (0.43) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL29415209 0.93 NOD1 (0.43) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL30516169 0.92 NOD1 (0.41) NOD1FNTAFNTBPGGT1BNPY4R
SCHEMBL27632323 0.91 NOD1 (0.51) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL27632326 0.91 NOD1 (0.51) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL30662552 0.91 NOD1 (0.42) NOD1FNTAFNTBPGGT1BC3AR1
SCHEMBL18378106 0.90 NOD1 (0.43) NOD1FNTAFNTBPGGT1BFOLH1
SCHEMBL18378107 0.90 NOD1 (0.43) NOD1FNTAFNTBPGGT1BFOLH1
SCHEMBL23391087 0.90 PTGS1 (0.41) NOD1FNTAFNTBPGGT1BNPY4R
SCHEMBL23391080 0.90 PTGS1 (0.41) NOD1FNTAFNTBPGGT1BNPY4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3218390-A2 TARGETED XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME Amunix Operating Inc. (US) 2017-09-20 — — EP claimed
WO-2016077505-A2 TARGETED XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX OPERATING INC. (US) 2016-05-19 — — WO claimed
US-20180125988-A1 TARGETED XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX OPERATING INC. 2018-05-10 — — US disclosed
EP-3218390-A2 TARGETED XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME Amunix Operating Inc. (US) 2017-09-20 — — EP disclosed
WO-2016077505-A2 TARGETED XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME AMUNIX OPERATING INC. (US) 2016-05-19 — — 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-20180125988-A1 TARGETED XTEN CONJUGATE COMPOSITIONS AND METHODS OF MAKING SAME ADAM33, ADAM12, PTMS NOD1 1740/4885FNTA 1106/4885FNTB 1635/4885

“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.

Send feedback