SCHEMBL20358461

SCHEMBL20358461

CC(C)(C)OC(=O)NCCCCC(CNC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
GAA P10253 1/20 0.56
TDP1 Q9NUW8 5/20 0.55
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
CA1 P00915 7/20 0.47
CA2 P00918 7/20 0.47
CA12 O43570 4/20 0.47
CA9 Q16790 4/20 0.47
SYK P43405 1/20 0.45
ATM Q13315 2/20 0.44
MAPT P10636 2/20 0.42
POLB P06746 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
CAPN1 P07384 1/20 0.42
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40

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
SCHEMBL13959018 0.90 MEN1 (0.52) MEN1KMT2AGAATDP1MAOA
SCHEMBL23168272 0.88 TDP1 (0.59) MEN1KMT2AGAATDP1MAOA
SCHEMBL10190369 0.88 TDP1 (0.59) MEN1KMT2AGAATDP1MAOA
SCHEMBL8062203 0.88 TDP1 (0.59) MEN1KMT2AGAATDP1MAOA
SCHEMBL20358462 0.87 MEN1 (0.52) MEN1KMT2AGAATDP1MAOA
SCHEMBL3082046 0.87 MEN1 (0.55) MEN1KMT2AGAATDP1MAOA
SCHEMBL13767609 0.87 MEN1 (0.55) MEN1KMT2AGAATDP1MAOA
SCHEMBL22162664 0.87 MEN1 (0.55) MEN1KMT2AGAATDP1MAOA
SCHEMBL3082048 0.87 MEN1 (0.55) MEN1KMT2AGAATDP1MAOA
SCHEMBL18379445 0.87 SYK (0.44) MEN1KMT2AGAATDP1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11951188-B2 Macrocyclic ligands with pendant chelating moieties and complexes thereof LUMIPHORE, INC. (US) 2024-04-09 US disclosed
US-20240067650-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF LUMIPHORE, INC. 2024-02-29 US disclosed
US-11603371-B2 Macrocyclic ligands with pendant chelating moieties and complexes thereof LUMIPHORE, INC. (US) 2023-03-14 US disclosed
EP-3762042-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF Lumiphore, Inc. (US) 2021-01-13 EP disclosed
US-20200405887-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF LUMIPHORE, INC. 2020-12-31 US disclosed
US-20200062757-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF LUMIPHORE, INC. 2020-02-27 US disclosed
WO-2019173639-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF LUMIPHORE, INC. (US) 2019-09-12 WO disclosed
US-10239878-B2 Macrocyclic ligands with pendant chelating moieties and complexes thereof LUMIPHORE, INC. (US) 2019-03-26 US disclosed
US-20180194766-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF LUMIPHORE, INC. 2018-07-12 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 (7 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-20200062757-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF TFRC, CLTC, SLC39A3 MEN1 390/4885KMT2A 3990/4885GAA 1195/4885
US-20240067650-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF TFRC, CLTC, SLC39A3 MEN1 390/4885KMT2A 3990/4885GAA 1195/4885
US-20180194766-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF TFRC, CLTC, SLC39A3 MEN1 390/4885KMT2A 3990/4885GAA 1195/4885
US-11603371-B2 Macrocyclic ligands with pendant chelating moieties and complexes thereof TFRC, CLTC, SLC39A3 MEN1 390/4885KMT2A 3990/4885GAA 1195/4885
US-10239878-B2 Macrocyclic ligands with pendant chelating moieties and complexes thereof TFRC, CLTC, SLC39A3 MEN1 390/4885KMT2A 3990/4885GAA 1195/4885
US-20200405887-A1 MACROCYCLIC LIGANDS WITH PENDANT CHELATING MOIETIES AND COMPLEXES THEREOF TFRC, CLTC, SLC39A3 MEN1 390/4885KMT2A 3990/4885GAA 1195/4885
US-11951188-B2 Macrocyclic ligands with pendant chelating moieties and complexes thereof TFRC, CLTC, SLC39A3 MEN1 390/4885KMT2A 3990/4885GAA 1195/4885

“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.