SCHEMBL4048788

SCHEMBL4048788

O=C1C(=O)c2cccnc2-c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 3/20 1.00
CTSL P07711 1/20 1.00
CTSS P25774 1/20 1.00
PTPN13 Q12923 1/20 1.00
TDP2 O95551 4/20 0.78
NSD2 O96028 3/20 0.78
PAX8 Q06710 3/20 0.78
PLCG1 P19174 2/20 0.78
CES1 P23141 2/20 0.78
ABL1 P00519 1/20 0.78
RIN1 Q13671 1/20 0.78
GAA P10253 1/20 0.71
ALDH1A1 P00352 2/20 0.65
TDP1 Q9NUW8 3/20 0.64
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
THRB P10828 2/20 0.64
BLM P54132 2/20 0.64
S100A4 P26447 6/20 0.59
CDC25B P30305 3/20 0.59

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
SCHEMBL30777768 1.00 PTPRC (1.00) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL69772 0.95 PTPRC (0.91) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL30799541 0.95 PTPRC (0.91) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL460433 0.88 TDP2 (1.00) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL29419580 0.88 TDP2 (1.00) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL1103717 0.86 GAA (0.78) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL460626 0.86 TDP2 (0.78) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL29746876 0.86 GAA (0.78) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL3275080 0.86 TDP2 (0.95) PTPRCCTSLCTSSPTPN13TDP2
SCHEMBL5696693 0.86 TDP2 (0.95) PTPRCCTSLCTSSPTPN13TDP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447525-A Phosphorescence-opening biological orthogonal iridium complex probe, and preparation and application thereof 南京邮电大学 2024-01-26 CN claimed
EP-1242086-B1 CD45 INHIBITORS ASTRAZENECA AB (SE) 2005-10-05 EP claimed
US-20030130298-A1 Cd45 inhibitors ASTRAZENECA AB (SE) 2003-07-10 US claimed
EP-1242086-A2 CD45 INHIBITORS AstraZeneca AB (SE) 2002-09-25 EP claimed
WO-2001045680-A2 CD45 INHIBITORS ASTRAZENECA AB (SE) 2001-06-28 WO claimed
CN-117447525-A Phosphorescence-opening biological orthogonal iridium complex probe, and preparation and application thereof 南京邮电大学 2024-01-26 CN disclosed
CN-117447525-A Phosphorescence-opening biological orthogonal iridium complex probe, and preparation and application thereof 南京邮电大学 2024-01-26 CN disclosed
EP-3560021-A1 BIOELECTRODE FOR DETECTING AND/OR OXIDISING GLUCOSE AND METHOD FOR THE PRODUCTION THEREOF AND DEVICE COMPRISING SAME Centre National De La Recherche Scientifique (FR) 2019-10-30 EP disclosed
EP-3328872-B1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-05-29 EP disclosed
US-20180226591-A1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-08-09 US disclosed
US-20180226591-A1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2018-08-09 US disclosed
WO-2017105063-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2017-06-22 WO disclosed
EP-2024371-A1 PHENANTHRENE DERIVATIVES AS MPGES-1 INHIBITORS Merck Frosst Canada Ltd. (CA) 2009-02-18 EP disclosed
WO-2007134434-A1 PHENANTHRENE DERIVATIVES AS MPGES-1 INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-11-29 WO disclosed
EP-1242086-B1 CD45 INHIBITORS ASTRAZENECA AB (SE) 2005-10-05 EP disclosed
US-20030130298-A1 Cd45 inhibitors ASTRAZENECA AB (SE) 2003-07-10 US disclosed
EP-1242086-A2 CD45 INHIBITORS AstraZeneca AB (SE) 2002-09-25 EP disclosed
WO-2001045680-A2 CD45 INHIBITORS ASTRAZENECA AB (SE) 2001-06-28 WO disclosed
US-4422972-A FOR PHOTOPOLYMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS EASTMAN KODAK COMPANY (US) 1983-12-27 US disclosed
US-4302527-A BIS/9,10-PHENANTHRONE-3-CARBOXYLATES/AS PHOTOINITIATORS; PHOTOPOLYMERIZATION; LITHOGRAPHY; PHOTORESISTS; COATINGS EASTMAN KODAK COMPANY (US) 1981-11-24 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-20180226591-A1 ELECTROLUMINESCENT BRIDGED METAL COMPLEXES FOR USE IN ELECTRONIC DEVICES EED, SOD1, NBAS PTPRC 1652/4885CTSL 3904/4885CTSS 1933/4885

“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.