SCHEMBL21359615

SCHEMBL21359615

CSC(=NC(=O)OC(C)(C)C)NC(C)=O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.31

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
SCHEMBL21359614 1.00 DGAT1 (0.31) DGAT1
SCHEMBL133918 0.86 KMT2A (0.33) DGAT1
SCHEMBL7865780 0.86 KMT2A (0.33) DGAT1
SCHEMBL206812 0.86 KMT2A (0.33) DGAT1
SCHEMBL15305057 0.84
SCHEMBL12231419 0.81 TDP1 (0.33) DGAT1
SCHEMBL18882631 0.81 TDP1 (0.33) DGAT1
SCHEMBL2348113 0.81 TDP1 (0.33) DGAT1
Sulfuric Acid SCHEMBL28494040 0.80 CA12 (0.33)
SCHEMBL15084705 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240293587-A1 CXCR4-TARGETED DIAGNOSTIC AND THERAPEUTIC AGENTS WITH REDUCED SPECIES SELECTIVITY Technische Universität München (DE) 2024-09-05 US disclosed
EP-3849997-B1 CXCR4-TARGETED DIAGNOSTIC AND THERAPEUTIC AGENTS WITH REDUCED SPECIES SELECTIVITY UNIV MUENCHEN TECH (DE) 2024-05-01 EP disclosed
US-11944691-B2 CXCR4-targeted diagnostic and therapeutic agents with reduced species selectivity Technische Universität München (DE) 2024-04-02 US disclosed
CN-111868060-B Dihydropyridino phthalazinone derivatives, preparation method and application thereof 上海艾力斯医药科技股份有限公司 2023-06-09 CN disclosed
US-20220040339-A1 CXCR4-TARGETED DIAGNOSTIC AND THERAPEUTIC AGENTS WITH REDUCED SPECIES SELECTIVITY Technische Universität München (DE) 2022-02-10 US disclosed
WO-2019174607-A1 DIHYDROPYRIDOPHTHALAZINONE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海艾力斯医药科技有限公司 2019-09-19 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-20220040339-A1 CXCR4-TARGETED DIAGNOSTIC AND THERAPEUTIC AGENTS WITH REDUCED SPECIES SELECTIVITY CXCR4, CXCR3, ACKR3 DGAT1 2918/4885
US-20240293587-A1 CXCR4-TARGETED DIAGNOSTIC AND THERAPEUTIC AGENTS WITH REDUCED SPECIES SELECTIVITY CXCR4, CXCR3, ACKR3 DGAT1 2918/4885
US-11944691-B2 CXCR4-targeted diagnostic and therapeutic agents with reduced species selectivity CXCR4, CXCR3, ACKR3 DGAT1 2918/4885

“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.