SCHEMBL3212823

SCHEMBL3212823

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 8/20 0.61
▸ CTSB P07858 3/20 0.54
▸ RAMP3 O60896 12/20 0.44
▸ CALCR P30988 12/20 0.44

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
SCHEMBL3871588 0.89 CAPN1 (0.53) CAPN1CTSB
SCHEMBL29379569 0.81 CAPN1 (0.62) CAPN1CTSBRAMP3CALCR
SCHEMBL30544033 0.79 CAPN1 (0.48) CAPN1RAMP3CALCR
SCHEMBL30518982 0.79 CAPN1 (0.53) CAPN1CTSBRAMP3CALCR
SCHEMBL31603948 0.79 CAPN1 (0.54) CAPN1CTSBRAMP3CALCR
SCHEMBL29630674 0.76 CAPN1 (0.53) CAPN1CTSB
SCHEMBL29876639 0.76 CAPN1 (0.62) CAPN1CTSB
SCHEMBL31226653 0.76 XIAP (0.56) CAPN1CTSB
SCHEMBL29576210 0.76 CAPN1 (0.55) CAPN1CTSB
SCHEMBL30610253 0.76 CAPN1 (0.61) CAPN1CTSB

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-8962697-B2 Bioreponsive polymers INTERFACE BIOLOGICS INC. (CA) 2015-02-24 — — US disclosed
US-20100041771-A1 Bioreponsive Polymers INTERFACE BIOLOGICS, INC. 2010-02-18 — — 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-20100041771-A1 Bioreponsive Polymers PEPD, PREP, DNPEP CAPN1 1234/4885CTSB 75/4885RAMP3 1357/4885

“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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