SCHEMBL4473309

SCHEMBL4473309

CC(C)(C)OC(=O)NC/C=C/CN

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.43
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
PTPN11 Q06124 1/20 0.38
CTSK P43235 2/20 0.38
CA1 P00915 6/20 0.38
CA2 P00918 6/20 0.38
CA12 O43570 4/20 0.36
CA9 Q16790 4/20 0.36
EPHX1 P07099 1/20 0.36
CA7 P43166 1/20 0.35
IDO1 P14902 1/20 0.35

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
SCHEMBL8260176 1.00 TDP1 (0.43) TDP1MAOAMAOBMEN1GAA
SCHEMBL4473312 1.00 TDP1 (0.43) TDP1MAOAMAOBMEN1GAA
Hydrochloric Acid SCHEMBL22121480 0.98 TDP1 (0.42) TDP1MAOAMAOBMEN1GAA
Hydrochloric Acid SCHEMBL21616394 0.98 TDP1 (0.42) TDP1MAOAMAOBMEN1GAA
SCHEMBL18262010 0.90 TDP1 (0.50) TDP1MAOAMAOBMEN1GAA
SCHEMBL18262007 0.90 TDP1 (0.50) TDP1MAOAMAOBMEN1GAA
SCHEMBL18487257 0.90 TDP1 (0.50) TDP1MAOAMAOBMEN1GAA
SCHEMBL17302431 0.86 TDP1 (0.41) TDP1MAOAMAOBMEN1GAA
SCHEMBL23992116 0.84 TDP1 (0.30) TDP1
SCHEMBL661593 0.83 TDP1 (0.49) TDP1MAOAMAOBMEN1GAA

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 113 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12637480-B2 Heterocyclic compounds as sting modulators BEONE MEDICINES I GMBH (CH) 2026-05-26 US disclosed
CN-122036541-A Amino acid-based ionizable lipid compound, and preparation method and application thereof 中国科学院广州生物医药与健康研究院 2026-05-15 CN disclosed
EP-4007758-B1 BIS-[N-((5-CARBAMOYL)-1H-BENZO[D]IMIDAZOL-2-YL)-PYRAZOL-5-CARBOXAMIDE] DERIVATIVES AND RELATED COMPOUNDS AS STING (STIMULATOR OF INTERFERON GENES) AGONISTS FOR THE TREATMENT OF CANCER MERSANA THERAPEUTICS INC (US) 2026-05-13 EP disclosed
EP-4673445-A1 STING AGONISTS CONTAINING BENZYLIC ALCOHOL AND BENZYLIC AMINE FUNCTIONAL GROUPS BioNTech SE (DE) 2026-01-07 EP disclosed
EP-4673439-A1 STING AGONISTS CONTAINING HYDRAZIDE, HYDRAZINE, AND HYDROXAMIC ACID FUNCTIONAL GROUPS BioNTech SE (DE) 2026-01-07 EP disclosed
WO-2025233676-A1 COMPOSITIONS AND METHODS RELATED TO A COMBINATION THERAPY OF STING AGONISTS AND IMMUNE CHECKPOINT INHIBITORS LIGACHEM BIOSCIENCES INC. (KR) 2025-11-13 WO disclosed
WO-2025233682-A1 ANTIBODY DRUG CONJUGATES COMPRISING STING AGONISTS AND USES THEREOF LIGACHEM BIOSCIENCES INC. (KR) 2025-11-13 WO disclosed
WO-2025233679-A1 COMPOSITIONS AND METHODS RELATED TO A COMBINATION THERAPY OF STING AGONISTS AND ANTIBODY DRUG CONJUGATES LIGACHEM BIOSCIENCES INC. (KR) 2025-11-13 WO disclosed
US-20250313557-A1 IMIDAZO[4,5-C]PYRIDINE DERIVATIVE COMPOUNDS AS TLR7/8 MODULATORS LIGACHEM BIOSCIENCES INC. (KR) 2025-10-09 US disclosed
EP-4620959-A1 CYCLIC COMPOUNDS USED AS MULTI-TARGET KINASE INHIBITORS AND PREPARATION METHOD THEREFOR Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences (CN) 2025-09-24 EP disclosed
WO-2016196956-A1 CELL-PERMEABLE, CELL-COMPATIBLE, AND CLEAVABLE LINKERS FOR COVALENT TETHERING OF FUNCTIONAL ELEMENTS PROMEGA CORPORATION (US) 2016-12-08 WO disclosed
US-7511077-B2 Diamine calcium channel blockers NEUROMED PHARMACEUTICALS LTD. (CA) 2009-03-31 US disclosed
US-7511077-B2 Diamine calcium channel blockers NEUROMED PHARMACEUTICALS LTD. (CA) 2009-03-31 US disclosed
US-7511077-B2 Diamine calcium channel blockers NEUROMED PHARMACEUTICALS LTD. (CA) 2009-03-31 US disclosed
EP-1846365-A1 DIAMINE CALCIUM CHANNEL BLOCKERS Neuromed Pharmaceuticals, Ltd. (CA) 2007-10-24 EP disclosed
WO-2006084369-A9 DIAMINE CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD (CA) 2007-01-11 WO disclosed
WO-2006084369-A9 DIAMINE CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD (CA) 2007-01-11 WO disclosed
US-20060235050-A1 Diamine calcium channel blockers NUEROMED TECHNOLOGIES, INC. (CA) 2006-10-19 US disclosed
WO-2006084369-A1 DIAMINE CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD. (CA) 2006-08-17 WO disclosed
WO-2006084369-A1 DIAMINE CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD. (CA) 2006-08-17 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-20060235050-A1 Diamine calcium channel blockers CACNA1G, CACNA1H, CACNA1I TDP1 1412/4885MAOA 834/4885MAOB 535/4885
US-12637480-B2 Heterocyclic compounds as sting modulators STING1, IFNAR1, IRF3 TDP1 508/4885MAOA 2205/4885MAOB 1586/4885
US-20250313557-A1 IMIDAZO[4,5-C]PYRIDINE DERIVATIVE COMPOUNDS AS TLR7/8 MODULATORS TLR7, TLR8, TLR3 TDP1 1884/4885MAOA 3859/4885MAOB 3918/4885

“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.