SCHEMBL4384952

SCHEMBL4384952

CCCCn1cnc2c1c(=O)n(C)c(=O)n2C

nearest known ligand 0.82

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 11/20 0.78
ADORA2A P29274 2/20 0.76
LMNA P02545 2/20 0.70
MAPT P10636 1/20 0.70
MAPK1 P28482 1/20 0.68
RXFP1 Q9HBX9 1/20 0.68
TSHR P16473 1/20 0.67
PDE4A P27815 2/20 0.64
PDE4B Q07343 2/20 0.64
PDE4C Q08493 2/20 0.64
PDE4D Q08499 2/20 0.64
ALDH1A1 P00352 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.61

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
SCHEMBL31482443 0.97 ADORA2B (0.81) ADORA2BADORA2ALMNAMAPTMAPK1
SCHEMBL11699832 0.95 ADORA2B (0.78) ADORA2BADORA2ALMNAMAPTMAPK1
SCHEMBL10394216 0.95 ADORA2B (0.78) ADORA2BADORA2ALMNAMAPTMAPK1
SCHEMBL11702145 0.95 ADORA2B (0.78) ADORA2BADORA2ALMNAMAPTMAPK1
SCHEMBL11701929 0.95 ADORA2B (0.78) ADORA2BADORA2ALMNAMAPTMAPK1
SCHEMBL16120979 0.92 ADORA2B (0.85) ADORA2BADORA2ALMNAMAPTMAPK1
SCHEMBL16120975 0.92 ADORA2B (0.88) ADORA2BADORA2ALMNAMAPTMAPK1
SCHEMBL8443037 0.90 ADORA2B (0.77) ADORA2BADORA2ALMNAMAPTPDE4A
SCHEMBL16120983 0.90 ADORA2B (0.85) ADORA2BADORA2ALMNAMAPTMAPK1
SCHEMBL16121000 0.90 ADORA2B (0.85) ADORA2BADORA2ALMNAMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119812357-A Membrane electrode of oxyhydrogen fuel cell and oxyhydrogen fuel cell comprising same 北京大学 2025-04-11 CN claimed
EP-3197458-B1 DERMOCOSMETIC OR PHARMACEUTICAL USE OF A COMPOSITION CONTAINING AT LEAST ONE INHIBITOR OF CERTAIN CHEMOATTRACTANT CYTOKINES GREENPHARMA S A (FR) 2021-03-31 EP claimed
US-20170296547-A1 DERMOCOSMETIC OR PHARMACEUTICAL USE OF A COMPOSITION COMPRISING AT LEAST ONE INHIBITOR OF SOME CHEMOATTRACTANT CYTOKINES UNIVERSITE DE STRASBOURG (FR) 2017-10-19 US claimed
CN-119812357-A Membrane electrode of oxyhydrogen fuel cell and oxyhydrogen fuel cell comprising same 北京大学 2025-04-11 CN disclosed
CN-115850279-B Theophylline derived spontaneous combustion ionic salt and preparation method thereof 哈尔滨工业大学(深圳) 2024-11-15 CN disclosed
CN-115850279-A Theophylline derived autoignition ionic salt and preparation method thereof 哈尔滨工业大学(深圳) 2023-03-28 CN disclosed
EP-3197458-B1 DERMOCOSMETIC OR PHARMACEUTICAL USE OF A COMPOSITION CONTAINING AT LEAST ONE INHIBITOR OF CERTAIN CHEMOATTRACTANT CYTOKINES GREENPHARMA S A (FR) 2021-03-31 EP disclosed
EP-3197458-B1 DERMOCOSMETIC OR PHARMACEUTICAL USE OF A COMPOSITION CONTAINING AT LEAST ONE INHIBITOR OF CERTAIN CHEMOATTRACTANT CYTOKINES GREENPHARMA S A (FR) 2021-03-31 EP disclosed
US-10828309-B2 Dermocosmetic or pharmaceutical use of a composition comprising at least one inhibitor of some chemoattractant cytokines GREENPHARMA (FR) 2020-11-10 US disclosed
US-10828309-B2 Dermocosmetic or pharmaceutical use of a composition comprising at least one inhibitor of some chemoattractant cytokines GREENPHARMA (FR) 2020-11-10 US disclosed
EP-3299371-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-03-28 EP disclosed
EP-2120871-B1 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES ACOSTA-ZARA EDGAR JOEL (CA) 2014-11-26 EP disclosed
CN-101636148-B Linker-based lecithin microemulsion delivery vehicle ACOSTA-ZARA EDGAR JOEL 2014-02-26 CN disclosed
US-20100303805-A1 IDENTIFICATION OF SMALL MOLECULES RECOGNIZED BY ANTIBODIES IN SUBJECTS WITH NEURODEGENERATIVE DISEASES THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-12-02 US disclosed
CN-101636148-A Linker-based lecithin microemulsion delivery vehicle JOEL ACOSTA-ZARA EDGAR 2010-01-27 CN disclosed
EP-2120871-A1 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES Acosta-Zara, Edgar, Joel (CA) 2009-11-25 EP disclosed
WO-2008070961-A1 LINKER-BASED LECITHIN MICROEMULSION DELIVERY VEHICLES ACOSTA-ZARA EDGAR JOEL (CA) 2008-06-19 WO disclosed
US-20080139392-A1 Linker-Based Lecithin Microemulsion Delivery Vehicles ACOSTA-ZARA EDGAR JOEL 2008-06-12 US disclosed
US-7160920-B2 Nitrosated and nitrosylated compounds and compositions and their use for treating respiratory disorders NITROMED, INC. (US) 2007-01-09 US disclosed
US-5550041-A PRODUCING 3-METHYL-7-ALKYLXANTHINE BY CULTIVATING PSEUDOMONAS TRANSFORMED TO PRODUCE CAFFEINE DEMETHYLASE IN NUTRIENT MEDIUM CONTAINING 1,3-DIMETHYL-7-ALKYLXANTHINE AMANO PHARMACEUTICAL CO., LTD. (JP) 1996-08-27 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 (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-20100303805-A1 IDENTIFICATION OF SMALL MOLECULES RECOGNIZED BY ANTIBODIES IN SUBJECTS WITH NEURODEGENERATIVE DISEASES PARK7, CLN6, NLN ADORA2B 3592/4885ADORA2A 3713/4885LMNA 4361/4885
US-20170296547-A1 DERMOCOSMETIC OR PHARMACEUTICAL USE OF A COMPOSITION COMPRISING AT LEAST ONE INHIBITOR OF SOME CHEMOATTRACTANT CYTOKINES CCL2, CCL11, CCL5 ADORA2B 1065/4885ADORA2A 762/4885LMNA 3426/4885
US-10828309-B2 Dermocosmetic or pharmaceutical use of a composition comprising at least one inhibitor of some chemoattractant cytokines CCL2, CCL11, CCL5 ADORA2B 1065/4885ADORA2A 762/4885LMNA 3426/4885

“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.