SCHEMBL23780010

SCHEMBL23780010

CC(C)(C)OC(=O)CCC(NC(=O)NC(CCC(=O)NCCCCCN)C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ KDM4A O75164 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ TET2 Q6N021 1/20 0.38
▸ DOHH Q9BU89 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ FOLH1 Q04609 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ SLC6A5 Q9Y345 2/20 0.38
▸ ATM Q13315 1/20 0.37
▸ SIRT6 Q8N6T7 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ P2RY12 Q9H244 1/20 0.36

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
SCHEMBL23780008 1.00 EPHX2 (0.38) EPHX2TDP1KDM4AHIF1ATET2
SCHEMBL11984370 0.96 TDP1 (0.37) EPHX2TDP1KDM4AHIF1ATET2
SCHEMBL4331941 0.96 TDP1 (0.37) EPHX2TDP1KDM4AHIF1ATET2
SCHEMBL18396046 0.95 FOLH1 (0.41) EPHX2TDP1KMT2AFOLH1MEN1
SCHEMBL18396048 0.95 FOLH1 (0.41) EPHX2TDP1KMT2AFOLH1MEN1
SCHEMBL30031700 0.95 FOLH1 (0.41) EPHX2TDP1KMT2AFOLH1MEN1
SCHEMBL16010863 0.95 FOLH1 (0.41) EPHX2TDP1KMT2AFOLH1MEN1
SCHEMBL16010862 0.95 FOLH1 (0.41) EPHX2TDP1KMT2AFOLH1MEN1
SCHEMBL18770775 0.93 KMT2A (0.43) TDP1KMT2AFOLH1MEN1POLB
SCHEMBL22228935 0.93 KMT2A (0.43) TDP1KMT2AFOLH1MEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250222143-A1 TARGETED RADIOTHERANOSTICS BASED ON POLYAZAMACROCYCLIC, MIXED-DONOR SCAFFOLDS LINKED TO A TARGETING VECTOR THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2025-07-10 — — US disclosed
WO-2023070004-A1 TARGETED RADIOTHERANOSTICS BASED ON POLYAZAMACROCYCLIC, MIXED-DONOR SCAFFOLDS LINKED TO A TARGETING VECTOR THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-04-27 — — WO disclosed
US-20210276971-A1 TRIAZAMACROCYCLE-DERIVED CHELATOR COMPOSITIONS FOR COORDINATION OF IMAGING AND THERAPY METAL IONS AND METHODS OF USING SAME THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2021-09-09 — — 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 (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-20250222143-A1 TARGETED RADIOTHERANOSTICS BASED ON POLYAZAMACROCYCLIC, MIXED-DONOR SCAFFOLDS LINKED TO A TARGETING VECTOR PAICS, RABGGTB, PARP1 EPHX2 3115/4885TDP1 1518/4885KDM4A 4084/4885
US-20210276971-A1 TRIAZAMACROCYCLE-DERIVED CHELATOR COMPOSITIONS FOR COORDINATION OF IMAGING AND THERAPY METAL IONS AND METHODS OF USING SAME PAICS, SLC39A14, SLC39A7 EPHX2 2767/4885TDP1 2980/4885KDM4A 2407/4885

“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.

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