SCHEMBL2198060

SCHEMBL2198060

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nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.36
CASP8 Q14790 4/20 0.36
CASP1 P29466 3/20 0.36
CASP7 P55210 3/20 0.36
ENPEP Q07075 5/20 0.35
BACE1 P56817 3/20 0.35
CTSD P07339 1/20 0.35
BACE2 Q9Y5Z0 1/20 0.34

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
SCHEMBL11037525 0.91 CTSC (0.39) ENPEP
SCHEMBL29375970 0.87 MME (0.46) ENPEPBACE1BACE2
SCHEMBL29375430 0.87 MME (0.46) ENPEPBACE1BACE2
SCHEMBL2183916 0.82 MME (0.37) ENPEP
SCHEMBL676220 0.82 BACE1 (0.48) CASP3CASP7BACE1BACE2
SCHEMBL2672789 0.82 OPRD1 (0.42) CASP1ENPEPBACE1CTSDBACE2
SCHEMBL2190022 0.81 CTSC (0.39) ENPEPBACE1CTSD
SCHEMBL30906339 0.81 MME (0.41) BACE1CTSD
SCHEMBL2181799 0.80 CTSC (0.34)
SCHEMBL30165201 0.79 ENPEP (0.43) CASP3CASP8CASP1CASP7ENPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST CASP3 3181/4885CASP8 4013/4885CASP1 4224/4885

“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.