SCHEMBL3345877

SCHEMBL3345877

Nc1nc(N)nc(-c2ccccn2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 1.00
L3MBTL1 Q9Y468 5/20 1.00
ALOX15 P16050 4/20 1.00
TDP1 Q9NUW8 3/20 0.71
TP53 P04637 4/20 0.58
LMNA P02545 3/20 0.54
CCR1 P32246 2/20 0.54
CCR5 P51681 2/20 0.54
CCR8 P51685 2/20 0.54
POLB P06746 2/20 0.54
METAP1 P53582 2/20 0.54
CYP1A2 P05177 1/20 0.54
BLM P54132 1/20 0.54
HIF1A Q16665 1/20 0.54
DOHH Q9BU89 1/20 0.54
P4HTM Q9NXG6 1/20 0.54
SMN1; SMN2 Q16637 5/20 0.52
HTT P42858 4/20 0.52
ALPL P05186 2/20 0.52
HSP90AA1 P07900 1/20 0.52

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
SCHEMBL29913760 1.00 KDM4E (1.00) KDM4EL3MBTL1ALOX15TDP1TP53
SCHEMBL4331114 0.96 KDM4E (0.92) KDM4EL3MBTL1ALOX15TDP1TP53
Dipyridyl SCHEMBL29167113 0.89 KDM4E (0.79) KDM4EL3MBTL1ALOX15TDP1TP53
SCHEMBL1704624 0.87 KDM4E (0.76) KDM4EL3MBTL1ALOX15TDP1TP53
SCHEMBL19445116 0.87 KDM4E (0.76) KDM4EL3MBTL1ALOX15TDP1TP53
SCHEMBL5848140 0.84 KDM4E (0.71) KDM4EL3MBTL1ALOX15TDP1TP53
SCHEMBL322756 0.84 KDM4E (1.00) KDM4EL3MBTL1ALOX15TDP1TP53
SCHEMBL29354466 0.84 KDM4E (1.00) KDM4EL3MBTL1ALOX15TDP1TP53
SCHEMBL1704219 0.82 KDM4E (0.69) KDM4EL3MBTL1ALOX15TDP1TP53
SCHEMBL30818096 0.82 KDM4E (0.69) KDM4EL3MBTL1ALOX15TDP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113122872-B Cobalt and nitrogen doped carbon nanotube/carbon electrocatalyst and preparation method and application thereof 合肥工业大学 2022-07-12 CN claimed
CN-113122872-A Cobalt and nitrogen doped carbon nanotube/carbon electrocatalyst and preparation method and application thereof 合肥工业大学 2021-07-16 CN claimed
US-4501689-A CONTAINING PYRIDINE OR IMIDAZOLE MODIFIED 5-TRIAZINE TAMURA KAKEN CO., LTD. (JP) 1985-02-26 US claimed
CN-117624137-A Triazine skeleton small molecule heparin reversal agent and preparation method and application thereof 中国药科大学 2024-03-01 CN disclosed
CN-117529476-A Preparation of substituted 1, 2-diamino heterocyclic derivatives and their use as medicaments 亚飞络思制药公司 2024-02-06 CN disclosed
CN-113122872-B Cobalt and nitrogen doped carbon nanotube/carbon electrocatalyst and preparation method and application thereof 合肥工业大学 2022-07-12 CN disclosed
CN-113122872-B Cobalt and nitrogen doped carbon nanotube/carbon electrocatalyst and preparation method and application thereof 合肥工业大学 2022-07-12 CN disclosed
CN-113122872-A Cobalt and nitrogen doped carbon nanotube/carbon electrocatalyst and preparation method and application thereof 合肥工业大学 2021-07-16 CN disclosed
CN-113122872-A Cobalt and nitrogen doped carbon nanotube/carbon electrocatalyst and preparation method and application thereof 合肥工业大学 2021-07-16 CN disclosed
US-9573117-B2 Catalyst precursors, catalysts and methods of producing same INSTITUTE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2017-02-21 US disclosed
CN-105555779-A Herbicidal azines BASF SE 2016-05-04 CN disclosed
EP-2673084-A1 CATALYSTS MADE USING THERMALLY DECOMPOSABLE POROUS SUPPORTS Institut National De La Recherche Scientifique (CA) 2013-12-18 EP disclosed
US-8580704-B2 Catalyst precursors, catalysts and methods of producing same INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2013-11-12 US disclosed
WO-2012107838-A1 CATALYSTS MADE USING THERMALLY DECOMPOSABLE POROUS SUPPORTS INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2012-08-16 WO disclosed
US-20110294658-A1 CATALYST PRECURSORS, CATALYSTS AND METHODS OF PRODUCING SAME INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2011-12-01 US disclosed
US-20110124649-A1 INHIBITORS OF HUMAN METHIONINE AMINOPEPTIDASE 1 AND METHODS OF TREATING DISORDERS THE JOHNS HOPKINS UNIVERSITY (US) 2011-05-26 US disclosed
US-20110124649-A1 INHIBITORS OF HUMAN METHIONINE AMINOPEPTIDASE 1 AND METHODS OF TREATING DISORDERS THE JOHNS HOPKINS UNIVERSITY (US) 2011-05-26 US disclosed
WO-2010051619-A1 CATALYST PRECURSORS, CATALYSTS AND METHODS OF PRODUCING SAME INSTITUT NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CA) 2010-05-14 WO disclosed
WO-2009064388-A2 INHIBITORS OF HUMAN METHIONINE AMINOPEPTIDASE 1 AND METHODS OF TREATING DISORDERS LIU JUN O (US) 2009-05-22 WO disclosed
US-4501689-A CONTAINING PYRIDINE OR IMIDAZOLE MODIFIED 5-TRIAZINE TAMURA KAKEN CO., LTD. (JP) 1985-02-26 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 (1 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-20110124649-A1 INHIBITORS OF HUMAN METHIONINE AMINOPEPTIDASE 1 AND METHODS OF TREATING DISORDERS METAP1, DNPEP, METAP2 KDM4E 2936/4885L3MBTL1 973/4885ALOX15 1374/4885

“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.