SCHEMBL5385200

SCHEMBL5385200

CC(=O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 4/20 0.58
MDM4 O15151 3/20 0.58
TP53 P04637 3/20 0.58
MDM2 Q00987 3/20 0.53
TLR2 O60603 2/20 0.50
TNF P01375 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL14559793 1.00 CASP3 (0.58) CASP3MDM4TP53MDM2TLR2
SCHEMBL12138344 1.00 CASP3 (0.58) CASP3MDM4TP53MDM2TLR2
SCHEMBL13256282 0.91 CASP3 (0.54) CASP3MDM4TP53MDM2KMT2A
SCHEMBL14586400 0.91 CASP3 (0.54) CASP3MDM4TP53MDM2KMT2A
SCHEMBL13382807 0.91 CASP3 (0.54) CASP3MDM4TP53MDM2KMT2A
SCHEMBL25173084 0.90 CASP3 (0.56) CASP3MDM4TP53MDM2TLR2
SCHEMBL14570616 0.90 CASP3 (0.56) CASP3MDM4TP53MDM2TLR2
SCHEMBL800126 0.90 CASP3 (0.56) CASP3MDM4TP53MDM2TLR2
SCHEMBL1486199 0.90 CASP3 (0.64) CASP3MDM4TP53MDM2KMT2A
SCHEMBL378040 0.90 CASP3 (0.64) CASP3MDM4TP53MDM2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285570-A1 THERAPEUTICALLY USEFUL CURE-PRO MOLECULES FOR E3 LIGASE MEDIATED DEGRADATION OF PROTEINS, AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY 2023-09-14 US disclosed
US-20230277553-A1 THERAPEUTIC COMPOSITION OF CURE-PRO COMPOUNDS FOR TARGETED DEGRADATION OF BET DOMAIN PROTEINS, AND METHODS OF MAKING AND USAGE CORNELL UNIVERSITY 2023-09-07 US disclosed
US-20230263893-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS ARVINAS OPERATIONS, INC. 2023-08-24 US disclosed
US-20170065719-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS ARVINAS OPERATIONS, INC. 2017-03-09 US disclosed
US-9096642-B2 Therapeutic compounds for immunomodulation AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-08-04 US disclosed
US-9045507-B2 Coumarin-based amino acids for use in enzyme activity and substrate specificity assays UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2015-06-02 US disclosed
US-20150087581-A1 Immunosuppression Modulating Compounds AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-03-26 US disclosed
US-20140199334-A1 Therapeutic Compounds for Immunomodulation AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2014-07-17 US disclosed
US-20100086957-A1 METHOD FOR MONITORING INTRACELLULAR TYROSINE PHOSPHATASE ACTIVITY UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2010-04-08 US disclosed
US-20070287670-A1 HUMAN GLUCAGON-LIKE PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-12-13 US disclosed
US-7238671-B2 Human glucagon-like-peptide-1 mimics and their use in the treatment of diabetes and related conditions BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-03 US disclosed
US-7193034-B2 Synthetic peptides, conjugation reagents and methods REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-03-20 US disclosed
US-7193034-B2 Synthetic peptides, conjugation reagents and methods REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-03-20 US disclosed
US-20070031892-A1 Novel coumarin-based amino acids for use in enzyme activity and substrate specificity assays USC 2007-02-08 US disclosed
US-20060035305-A1 Synthetic peptides, conjugation reagents and methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2006-02-16 US disclosed
US-6939945-B2 Synthetic peptides, conjugation reagents and methods THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-09-06 US disclosed
US-20030073157-A1 Synthetic peptides, conjugation reagents and methods REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2003-04-17 US disclosed
US-6465612-B1 A PEPTIDE CONTAINING A (2S)-AMINOLEVULINIC ACID RESIDUE WITH SUBSTITUTED OR UNSUBSTITUTED KETONE GROUP THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-10-15 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-20070287670-A1 HUMAN GLUCAGON-LIKE PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS GLP1R, IAPP, GIPR CASP3 513/4885MDM4 4381/4885TP53 3992/4885
US-20100086957-A1 METHOD FOR MONITORING INTRACELLULAR TYROSINE PHOSPHATASE ACTIVITY PTPRCAP, PTPRC, PTPA CASP3 3800/4885MDM4 1983/4885TP53 587/4885
US-20060035305-A1 Synthetic peptides, conjugation reagents and methods PTMS, QPCT, LNPEP CASP3 3160/4885MDM4 1134/4885TP53 1147/4885
US-20230285570-A1 THERAPEUTICALLY USEFUL CURE-PRO MOLECULES FOR E3 LIGASE MEDIATED DEGRADATION OF PROTEINS, AND METHODS OF MAKING AND USING THEM XIAP, CUL4A, CUL1 CASP3 2917/4885MDM4 702/4885TP53 175/4885
US-20230277553-A1 THERAPEUTIC COMPOSITION OF CURE-PRO COMPOUNDS FOR TARGETED DEGRADATION OF BET DOMAIN PROTEINS, AND METHODS OF MAKING AND USAGE BET1, BRD4, PHKB CASP3 3107/4885MDM4 1478/4885TP53 215/4885
US-20140199334-A1 Therapeutic Compounds for Immunomodulation CD274, PDCD1, PDCD1LG2 CASP3 948/4885MDM4 660/4885TP53 44/4885
US-20230263893-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS BRPF3, STUB1, BRDT CASP3 3488/4885MDM4 471/4885TP53 196/4885
US-20170065719-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BROMODOMAIN-CONTAINING PROTEINS BRPF3, STUB1, BRDT CASP3 3488/4885MDM4 471/4885TP53 196/4885
US-20150087581-A1 Immunosuppression Modulating Compounds CD274, PDCD1, PDCD1LG2 CASP3 730/4885MDM4 438/4885TP53 51/4885

“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.