SCHEMBL29880860

SCHEMBL29880860

N=C(N)NCCC[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CC(=O)O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GNPAT O15228 2/20 0.41
▸ NPY4R P50391 10/20 0.40
▸ NPY1R P25929 6/20 0.40
▸ NPY2R P49146 4/20 0.40
▸ NPY5R Q15761 4/20 0.40
▸ NOD1 Q9Y239 3/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ GSTK1 Q9Y2Q3 1/20 0.38
▸ ITGB3 P05106 1/20 0.37
▸ ITGA2B P08514 1/20 0.37
▸ KEAP1 Q14145 1/20 0.37
▸ C3AR1 Q16581 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
SCHEMBL29942412 0.96 NPY4R (0.41) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL29493538 0.94 GNPAT (0.40) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL29415209 0.93 NOD1 (0.43) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL30867028 0.92 NPY4R (0.42) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL29750820 0.92 NPY4R (0.42) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL31099287 0.91 NOD1 (0.45) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL30662552 0.91 NOD1 (0.42) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL5849470 0.91 OPRL1 (0.40) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL5849482 0.91 OPRL1 (0.40) GNPATNPY4RNPY1RNPY2RNPY5R
SCHEMBL31078265 0.90 NPY4R (0.47) GNPATNPY4RNPY1RNPY2RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11413352-B2 Conjugate based systems for controlled insulin delivery Merck, Sharp & Dohme LLC (US) 2022-08-16 — — 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 (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-11413352-B2 Conjugate based systems for controlled insulin delivery GPR119, INSR, IGF1R GNPAT 1290/4885NPY4R 212/4885NPY1R 189/4885

“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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