SCHEMBL2194721

SCHEMBL2194721

CC(C)C[C@@H]([C]=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCC(N)=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 8/20 0.36
▸ DPP4 P27487 1/20 0.35
▸ DPP8 Q6V1X1 1/20 0.35
▸ DPP9 Q86TI2 1/20 0.35
▸ GRPR P30550 2/20 0.35
▸ NPY4R P50391 4/20 0.34
▸ NPY1R P25929 3/20 0.34
▸ NPY2R P49146 3/20 0.34
▸ NPY5R Q15761 2/20 0.34
▸ CTSD P07339 1/20 0.33
▸ REN P00797 1/20 0.33

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
SCHEMBL2192303 0.93 NPY4R (0.36) BACE1DPP4DPP8DPP9GRPR
SCHEMBL2183538 0.87 NPY4R (0.33) BACE1DPP4DPP8DPP9NPY4R
SCHEMBL2181812 0.85 BACE1 (0.34) BACE1CTSD
SCHEMBL1650463 0.84 CTSC (0.42) BACE1GRPR
SCHEMBL2159226 0.84 NPY4R (0.50) NPY4RNPY1RNPY2RNPY5R
SCHEMBL31482979 0.83 MME (0.38) BACE1DPP4DPP8DPP9NPY4R
SCHEMBL29590459 0.83 MME (0.38) BACE1DPP4DPP8DPP9NPY4R
SCHEMBL29630607 0.83 MME (0.38) BACE1DPP4DPP8DPP9NPY4R
SCHEMBL9409322 0.83 CTSC (0.34) —
SCHEMBL29630385 0.82 BACE1 (0.39) BACE1DPP4DPP8DPP9NPY4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9173951-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2015-11-03 — — US disclosed
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2015-02-19 — — US disclosed
US-8680263-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2014-03-25 — — US disclosed
US-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2011-07-14 — — 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-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST BACE1 3429/4885DPP4 193/4885DPP8 274/4885
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST BACE1 3429/4885DPP4 193/4885DPP8 274/4885

“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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