SCHEMBL21458032

SCHEMBL21458032

CCNC(=O)C(=O)C(Cc1ccccc1)NC(=O)C(CC(C)C)NC(=O)OCCOC

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 8/20 0.75
CAPN2 P17655 1/20 0.51
CTSK P43235 4/20 0.49
CTSL P07711 4/20 0.49
CTSB P07858 3/20 0.49
CTSS P25774 2/20 0.49

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
SCHEMBL20834985 1.00 CAPN1 (0.75) CAPN1CAPN2CTSKCTSLCTSB
SCHEMBL4402033 1.00 CAPN1 (0.75) CAPN1CAPN2CTSKCTSLCTSB
SCHEMBL21458034 0.92 CAPN1 (0.72) CAPN1CTSKCTSLCTSBCTSS
SCHEMBL4395935 0.92 CAPN1 (0.72) CAPN1CTSKCTSLCTSBCTSS
SCHEMBL20873422 0.92 CAPN1 (0.75) CAPN1CTSKCTSLCTSBCTSS
SCHEMBL4393092 0.92 CAPN1 (0.75) CAPN1CTSKCTSLCTSBCTSS
SCHEMBL8293258 0.91 CAPN1 (0.63) CAPN1
SCHEMBL21457982 0.91 CAPN1 (0.62) CAPN1CAPN2CTSKCTSLCTSB
SCHEMBL4390231 0.91 CAPN1 (0.62) CAPN1CAPN2CTSKCTSLCTSB
SCHEMBL20880271 0.91 CAPN1 (0.70) CAPN1CAPN2CTSKCTSLCTSS

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-11844776-B2 Composition for treatment and/or prevention of peripheral nerve disorder OSAKA CITY UNIVERSITY (JP) 2023-12-19 US disclosed
US-20190314320-A1 COMPOSITION FOR TREATMENT AND/OR PREVENTION OF PERIPHERAL NERVE DISORDER OSAKA CITY UNIVERSITY (JP) 2019-10-17 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-20190314320-A1 COMPOSITION FOR TREATMENT AND/OR PREVENTION OF PERIPHERAL NERVE DISORDER PMP22, PRPH, NGF CAPN1 4158/4885CAPN2 4100/4885CTSK 4322/4885
US-11844776-B2 Composition for treatment and/or prevention of peripheral nerve disorder PMP22, PRPH, NGF CAPN1 4158/4885CAPN2 4100/4885CTSK 4322/4885

“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.