SCHEMBL2597563

SCHEMBL2597563

O=C(O)CN(CCN(CC(=O)O)C[C@H](Cc1ccccc1)N(CC(=O)O)CC(=O)O)CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
EYA2 O00167 1/20 0.42
APP P05067 1/20 0.42
ACE P12821 1/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
CHRM2 P08172 1/20 0.41
ADRA2A P08913 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
DRD1 P21728 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
CYP2C19 P33261 1/20 0.41
ADRA1A P35348 1/20 0.41
DRD3 P35462 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HRH3 Q9Y5N1 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
SCHEMBL3108023 1.00 TDP1 (0.42) TDP1EYA2APPACEKDM4E
SCHEMBL2999347 1.00 TDP1 (0.42) TDP1EYA2APPACEKDM4E
SCHEMBL29505895 0.92 CYP1A2 (0.43) CYP1A2CPA1CPA3CPB1CPB2
SCHEMBL30175842 0.90 TDP1 (0.39) TDP1EYA2APPACEKDM4E
SCHEMBL9164952 0.89 CA1 (0.52) CA1CA2CA4
SCHEMBL9166812 0.89 CA1 (0.49) CA1CA2CA4
SCHEMBL8842200 0.88 OPRD1 (0.41) TDP1EYA2APPACEKDM4E
SCHEMBL9457215 0.88 MAOB (0.36) MAOBOPRM1OPRD1OPRK1CA1
SCHEMBL8090970 0.88 MAOB (0.57) MAOBKEAP1
SCHEMBL21652462 0.87 TDP1 (0.39) TDP1EYA2APPACEKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3570897-B1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES THERAPHARM GMBH (CH) 2023-10-04 EP claimed
CN-115721742-A Radioactive immunoconjugates and their use for bone marrow pretreatment or treatment of bone marrow related diseases 塞拉法尔目有限责任公司 2023-03-03 CN claimed
US-20220401594-A1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES THERAPHARM GMBH (CH) 2022-12-22 US claimed
WO-2018134430-A1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES THERAPHARM GMBH (CH) 2018-07-26 WO claimed
EP-3351271-A1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES TheraPharm GmbH (CH) 2018-07-25 EP claimed
EP-1962913-B1 RADIOIMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA THERAPHARM GMBH (CH) 2013-12-04 EP claimed
US-20100183505-A1 IMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA AND OTHER HAEMATOLOGICAL MALIGNANCIES THERAPHARM GMBH 2010-07-22 US claimed
EP-1962913-A2 RADIOIMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA Therapharm GmbH (CH) 2008-09-03 EP claimed
WO-2007062855-A2 RADIOIMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA THERAPHARM GMBH (CH) 2007-06-07 WO claimed
EP-3570897-B1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES THERAPHARM GMBH (CH) 2023-10-04 EP disclosed
CN-115721742-A Radioactive immunoconjugates and their use for bone marrow pretreatment or treatment of bone marrow related diseases 塞拉法尔目有限责任公司 2023-03-03 CN disclosed
US-20220401594-A1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES THERAPHARM GMBH (CH) 2022-12-22 US disclosed
WO-2018134430-A1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES THERAPHARM GMBH (CH) 2018-07-26 WO disclosed
EP-3351271-A1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES TheraPharm GmbH (CH) 2018-07-25 EP disclosed
US-9072797-B2 Immunoconjugate for human CD66 for the treatment of multiple myeloma and other haematological malignancies THERAPHARM GMBH (CH) 2015-07-07 US disclosed
EP-1962913-B1 RADIOIMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA THERAPHARM GMBH (CH) 2013-12-04 EP disclosed
WO-2011144744-A1 TARGETED RADIOACTIVE COMPOUND FOR HUMAN CD66 FOR THE TREATMENT OF DISORDERS THERAPHARM GMBH (CH) 2011-11-24 WO disclosed
US-20100183505-A1 IMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA AND OTHER HAEMATOLOGICAL MALIGNANCIES THERAPHARM GMBH 2010-07-22 US disclosed
EP-1962913-A2 RADIOIMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA Therapharm GmbH (CH) 2008-09-03 EP disclosed
WO-2007062855-A2 RADIOIMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA THERAPHARM GMBH (CH) 2007-06-07 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 (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-20220401594-A1 RADIOIMMUNOCONJUGATE FOR USE IN TREATING BONE MARROW ASSOCIATED DISEASES FCGR2A, FCGR3B, BST2 TDP1 2526/4885EYA2 2637/4885APP 900/4885
US-20100183505-A1 IMMUNOCONJUGATE FOR HUMAN CD66 FOR THE TREATMENT OF MULTIPLE MYELOMA AND OTHER HAEMATOLOGICAL MALIGNANCIES CD63, CD47, CD22 TDP1 3627/4885EYA2 2709/4885APP 4784/4885

“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.