SCHEMBL21471758

SCHEMBL21471758

CN[C@@H](C)C(=O)NC(C(=O)N1CCC[C@H]1c1nc(-c2cccc3ccccc23)cs1)C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BIRC2 Q13490 12/20 0.46
XIAP P98170 11/20 0.46
BIRC3 Q13489 5/20 0.46
TRPV1 Q8NER1 1/20 0.42

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
SCHEMBL24787860 1.00 BIRC2 (0.46) BIRC2XIAPBIRC3TRPV1
SCHEMBL21649519 1.00 BIRC2 (0.46) BIRC2XIAPBIRC3TRPV1
SCHEMBL21935284 1.00 BIRC2 (0.46) BIRC2XIAPBIRC3TRPV1
SCHEMBL22458873 1.00 BIRC2 (0.46) BIRC2XIAPBIRC3TRPV1
SCHEMBL13576665 1.00 BIRC2 (0.46) BIRC2XIAPBIRC3TRPV1
SCHEMBL15583326 0.93 XIAP (0.40) BIRC2XIAPBIRC3TRPV1
SCHEMBL13209756 0.93 XIAP (0.40) BIRC2XIAPBIRC3TRPV1
SCHEMBL13576668 0.93 XIAP (0.44) BIRC2XIAPBIRC3TRPV1
SCHEMBL13576664 0.93 XIAP (0.44) BIRC2XIAPBIRC3TRPV1
SCHEMBL13576832 0.93 TRPV1 (0.40) BIRC2XIAPBIRC3TRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2023-07-25 US disclosed
US-20230000994-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES YALE UNIVERSITY 2023-01-05 US disclosed
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2022-12-22 US disclosed
US-11173211-B2 Compounds and methods for the targeted degradation of rapidly accelerated Fibrosarcoma polypeptides ARVINAS OPERATIONS, INC. (US) 2021-11-16 US disclosed
US-11161841-B2 Modulators of proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2021-11-02 US disclosed
US-20200297725-A1 ALLOSTERIC BCR-ABL PROTEOLYSIS TARGETING CHIMERIC COMPOUNDS YALE UNIVERSITY 2020-09-24 US disclosed
US-20200129627-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES ARVINAS OPERATIONS, INC. 2020-04-30 US disclosed
US-20200038513-A1 MODULATORS OF FAK PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2020-02-06 US disclosed
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 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 (9 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-20200129627-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES CRBN, ARAF, VHL BIRC2 36/4885XIAP 10/4885BIRC3 134/4885
US-11173211-B2 Compounds and methods for the targeted degradation of rapidly accelerated Fibrosarcoma polypeptides CRBN, ARAF, VHL BIRC2 36/4885XIAP 10/4885BIRC3 134/4885
US-20200038513-A1 MODULATORS OF FAK PROTEOLYSIS AND ASSOCIATED METHODS OF USE PTK2, CTTN, CRBN BIRC2 474/4885XIAP 10/4885BIRC3 1056/4885
US-20190315732-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL BIRC2 112/4885XIAP 7/4885BIRC3 239/4885
US-20230000994-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES CRBN, ARAF, VHL BIRC2 36/4885XIAP 10/4885BIRC3 134/4885
US-20220402907-A1 MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE MDM2, CRBN, VHL BIRC2 112/4885XIAP 7/4885BIRC3 239/4885
US-11707452-B2 Modulators of alpha-synuclein proteolysis and associated methods of use UCHL1, ADRM1, CRBN BIRC2 87/4885XIAP 9/4885BIRC3 196/4885
US-20200297725-A1 ALLOSTERIC BCR-ABL PROTEOLYSIS TARGETING CHIMERIC COMPOUNDS BCR, ABL1, ABL2 BIRC2 247/4885XIAP 48/4885BIRC3 291/4885
US-11161841-B2 Modulators of proteolysis and associated methods of use MDM2, CRBN, VHL BIRC2 112/4885XIAP 7/4885BIRC3 239/4885

“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.