SCHEMBL17805291

SCHEMBL17805291

CN1CCNCCN(CCCNC(=O)OC(C)(C)C)CCNCC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 11/20 0.52
▸ SIGMAR1 Q99720 3/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ ACHE P22303 1/20 0.43
▸ BACE1 P56817 1/20 0.43
▸ CACNA1H O95180 1/20 0.42

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
SCHEMBL14873885 0.96 DRD2 (0.55) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL22783652 0.93 DRD2 (0.56) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL829612 0.92 DRD2 (0.56) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL25128846 0.91 DRD2 (0.51) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL24913972 0.90 DRD2 (0.57) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL22783648 0.88 DRD2 (0.52) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL513795 0.87 MEN1 (0.55) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL13609474 0.87 DRD2 (0.60) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL31301221 0.86 DRD2 (0.55) DRD2SIGMAR1TDP1MEN1KMT2A
SCHEMBL8254760 0.85 DRD2 (0.64) DRD2SIGMAR1TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3909948-B1 BIFUNCTIONAL DO2PA DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF CENTRE NAT RECH SCIENT (FR) 2024-02-28 — — EP disclosed
US-20220143230-A1 BIFUNCTIONAL do2pa DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2022-05-12 — — US disclosed
US-11266754-B2 Bifunctional do2pa derivatives, chelates with metallic cations and use thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2022-03-08 — — US disclosed
EP-3909948-A1 BIFUNCTIONAL DO2PA DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2021-11-17 — — EP disclosed
EP-3227272-B1 BIFUNCTIONAL DO2PA DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF CENTRE NAT RECH SCIENT (FR) 2021-07-07 — — EP disclosed
US-20200038527-A1 BIFUNCTIONAL do2pa DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2020-02-06 — — US disclosed
US-20170326261-A1 BIFUNCTIONAL do2pa DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2017-11-16 — — US disclosed
US-20170326261-A1 BIFUNCTIONAL do2pa DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2017-11-16 — — US disclosed
WO-2016087667-A1 BIFUNCTIONAL do2pa DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2016-06-09 — — WO disclosed
EP-3029032-A1 Bifunctional do2pa derivatives, chelates with metallic cations and use thereof Centre National de la Recherche Scientifique (CNRS) (FR) 2016-06-08 — — EP 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 (4 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-20200038527-A1 BIFUNCTIONAL do2pa DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF AP2A2, ATP2A2, SLC20A2 DRD2 176/4885SIGMAR1 271/4885TDP1 2690/4885
US-20220143230-A1 BIFUNCTIONAL do2pa DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF AP2A2, ATP2A2, SLC20A2 DRD2 176/4885SIGMAR1 271/4885TDP1 2690/4885
US-20170326261-A1 BIFUNCTIONAL do2pa DERIVATIVES, CHELATES WITH METALLIC CATIONS AND USE THEREOF AP2A2, ATP2A2, SLC20A2 DRD2 176/4885SIGMAR1 271/4885TDP1 2690/4885
US-11266754-B2 Bifunctional do2pa derivatives, chelates with metallic cations and use thereof AP2A2, ATP2A2, SLC20A2 DRD2 176/4885SIGMAR1 271/4885TDP1 2690/4885

“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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