SCHEMBL24224252

SCHEMBL24224252

CC(C)CC(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
REN P00797 7/20 0.71
CTSS P25774 3/20 0.64
CTSK P43235 2/20 0.64
CTSL P07711 1/20 0.64
CTSB P07858 1/20 0.64
MAPK1 P28482 1/20 0.62
ACE P12821 1/20 0.61
MME P08473 2/20 0.60

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
SCHEMBL3498474 1.00 REN (0.71) RENCTSSCTSKCTSLCTSB
SCHEMBL28611118 1.00 REN (0.71) RENCTSSCTSKCTSLCTSB
SCHEMBL12242944 1.00 REN (0.71) RENCTSSCTSKCTSLCTSB
SCHEMBL18229266 1.00 REN (0.71) RENCTSSCTSKCTSLCTSB
SCHEMBL7269523 1.00 REN (0.71) RENCTSSCTSKCTSLCTSB
SCHEMBL9551232 0.99 REN (0.73) RENCTSSCTSKCTSLCTSB
SCHEMBL5994686 0.96 REN (0.73) RENCTSSCTSKCTSLCTSB
SCHEMBL9101385 0.96 REN (0.73) RENCTSSCTSKCTSLCTSB
SCHEMBL6897460 0.96 REN (0.73) RENCTSSCTSKCTSLCTSB
SCHEMBL3046634 0.96 REN (0.73) RENCTSSCTSKCTSLCTSB

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-20220024949-A1 CU-AND NI-CATALYZED DECARBOXYLATIVE BORYLATION REACTIONS THE SCRIPPS RESEARCH INSTITUTE 2022-01-27 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-20220024949-A1 CU-AND NI-CATALYZED DECARBOXYLATIVE BORYLATION REACTIONS PCSK9, PCSK7, PCSK6 REN 100/4885CTSS 309/4885CTSK 32/4885

“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.