SCHEMBL21458045

SCHEMBL21458045

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

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 7/20 0.58
PSMB1 P20618 1/20 0.57
CTSK P43235 6/20 0.51
CTSL P07711 3/20 0.48
CTSS P25774 3/20 0.48
CTSB P07858 1/20 0.48
CA5A P35218 1/20 0.48
CAPN2 P17655 1/20 0.48

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
SCHEMBL4391579 1.00 CAPN1 (0.58) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL4400925 0.94 CAPN1 (0.56) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL21457975 0.94 CAPN1 (0.56) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL4394789 0.93 CAPN1 (0.54) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL21458035 0.93 CAPN1 (0.54) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL20834987 0.92 CAPN1 (0.58) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL3840049 0.92 CAPN1 (0.58) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL21457976 0.92 CAPN1 (0.58) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL4392057 0.89 CAPN1 (0.54) CAPN1PSMB1CTSKCTSLCTSS
SCHEMBL4391906 0.86 CAPN1 (0.62) CAPN1PSMB1CTSKCTSLCTSS

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 4158/4885PSMB1 2040/4885CTSK 4322/4885
US-11844776-B2 Composition for treatment and/or prevention of peripheral nerve disorder PMP22, PRPH, NGF CAPN1 4158/4885PSMB1 2040/4885CTSK 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.