SCHEMBL21724565

SCHEMBL21724565

CC(NC(=O)C(CC(N)=O)NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 9/20 0.51
REN P00797 1/20 0.46
CTSS P25774 5/20 0.46
CTSK P43235 5/20 0.46
CTSL P07711 1/20 0.46
CTSB P07858 1/20 0.46
APP P05067 1/20 0.42
SCN9A Q15858 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL9980636 1.00 BACE1 (0.51) BACE1RENCTSSCTSKCTSL
SCHEMBL21724562 1.00 BACE1 (0.51) BACE1RENCTSSCTSKCTSL
SCHEMBL21724228 1.00 BACE1 (0.51) BACE1RENCTSSCTSKCTSL
Hydrochloric Acid SCHEMBL21724538 0.99 BACE1 (0.50) BACE1RENCTSSCTSKCTSL
Hydrochloric Acid SCHEMBL21724540 0.99 BACE1 (0.50) BACE1RENCTSSCTSKCTSL
SCHEMBL30910800 0.89 BACE1 (0.48) BACE1RENCTSSCTSKCTSL
SCHEMBL30511412 0.89 BACE1 (0.48) BACE1RENCTSSCTSKCTSL
SCHEMBL21737915 0.89 BACE1 (0.48) BACE1RENCTSSCTSKCTSL
Hydrochloric Acid SCHEMBL30511421 0.87 BACE1 (0.48) BACE1RENCTSSCTSKCTSL
SCHEMBL23404059 0.86 REN (0.47) BACE1RENCTSSCTSKCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11998610-B2 Conjugates and methods of using the same FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2024-06-04 US disclosed
US-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES INC (US) 2023-07-27 US disclosed
WO-2021252640-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME SENDA BIOSCIENCES, INC. (US) 2021-12-16 WO disclosed
EP-3836971-A1 CONJUGATES AND METHODS OF USING THE SAME Flagship Pioneering Innovations V, Inc. (US) 2021-06-23 EP disclosed
US-20210162057-A1 CONJUGATES AND METHODS OF USING THE SAME FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-06-03 US disclosed
WO-2021043194-A1 HALOGENATED TETRACYCLIC TRITERPENE DERIVATIVE, PREPARATION AND APPLICATION THEREOF 上海青玄生物科技有限公司 2021-03-11 WO disclosed
WO-2020037009-A1 CONJUGATES AND METHODS OF USING THE SAME FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2020-02-20 WO 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 (3 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-11998610-B2 Conjugates and methods of using the same CD47, CD44, CD74 BACE1 4427/4885REN 4014/4885CTSS 653/4885
US-20230234917-A1 ASPARAGINE DERIVATIVES AND METHODS OF USING SAME ASNS, SI, NARS1 BACE1 804/4885REN 1275/4885CTSS 831/4885
US-20210162057-A1 CONJUGATES AND METHODS OF USING THE SAME CD47, CD44, CD74 BACE1 4427/4885REN 4014/4885CTSS 653/4885

“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.