SCHEMBL2183047

SCHEMBL2183047

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

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 1/20 0.35
▸ CTSD P07339 2/20 0.33
▸ BACE1 P56817 7/20 0.33
▸ GRPR P30550 2/20 0.32
▸ CASP3 P42574 1/20 0.31
▸ CASP7 P55210 1/20 0.31

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
SCHEMBL2186474 0.85 CTSC (0.37) CTSCBACE1
SCHEMBL20397445 0.85 FNTA (0.37) CTSDBACE1CASP3CASP7
SCHEMBL31049654 0.85 CTSD (0.38) CTSDBACE1CASP3CASP7
SCHEMBL20397476 0.85 FNTA (0.37) CTSDBACE1CASP3CASP7
SCHEMBL16468413 0.84 CTSL (0.46) —
SCHEMBL29881377 0.83 CTSD (0.35) CTSCCTSDBACE1CASP3CASP7
SCHEMBL5499034 0.82 CTSC (0.42) CTSC
SCHEMBL9012496 0.82 CTSC (0.42) CTSC
SCHEMBL3750881 0.82 MME (0.41) —
SCHEMBL3750892 0.82 MME (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 — — 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-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CTSC 331/4885CTSD 1192/4885BACE1 2543/4885

“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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