SCHEMBL741061

SCHEMBL741061

NC(=O)c1cncc(Cl)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 0.50
LMNA P02545 1/20 0.48
ADORA3 P0DMS8 1/20 0.47
TSHR P16473 1/20 0.47
MC4R P32245 1/20 0.47
ADRA1A P35348 1/20 0.47
MC3R P41968 1/20 0.47
CDK2 P24941 3/20 0.46
GRM5 P41594 1/20 0.46
S1PR3 Q99500 1/20 0.39
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
MAP4K4 O95819 1/20 0.37
CTSA P10619 1/20 0.37
ICAM1 P05362 1/20 0.36
SELE P16581 1/20 0.36
VCAM1 P19320 1/20 0.36
DGAT1 O75907 3/20 0.35
KCNH2 Q12809 1/20 0.35
POLB P06746 1/20 0.33

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
SCHEMBL31555012 1.00 SIRT6 (0.50) SIRT6LMNAADORA3TSHRMC4R
SCHEMBL27820932 0.89 GRM5 (0.43) SIRT6LMNAADORA3TSHRMC4R
Trifluoroacetic Acid SCHEMBL31325621 0.88 SIRT6 (0.41) SIRT6LMNAADORA3TSHRMC4R
SCHEMBL7109264 0.84 TSHR (0.56) SIRT6LMNAADORA3TSHRMC4R
SCHEMBL27858703 0.82 GRM5 (0.49) SIRT6LMNAADORA3TSHRMC4R
SCHEMBL376231 0.80 GRM5 (0.47) SIRT6LMNAADORA3TSHRMC4R
SCHEMBL376147 0.80 GRM5 (0.47) SIRT6ADORA3TSHRMC4RADRA1A
SCHEMBL29913176 0.80 GRM5 (0.47) SIRT6ADORA3TSHRMC4RADRA1A
SCHEMBL24144974 0.78 CDK2 (0.46) SIRT6LMNACDK2GRM5S1PR3
SCHEMBL30354632 0.78 GRM5 (0.46) SIRT6CDK2GRM5S1PR3CTSA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108997228-A The preparation method and application of 6- chloropyrazine -2- amides compound containing diphenyl ether base 陈磊 2018-12-14 CN claimed
CN-108892646-A Chloro- 2- pyrazinamide class compound of a kind of 6- containing diphenyl ether base and the preparation method and application thereof 上海凯爱网络科技有限公司 2018-11-27 CN claimed
EP-2074089-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-09-18 EP claimed
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 US claimed
US-20100190773-A1 Anti-Cytokine Heterocyclic Compounds BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-07-29 US claimed
EP-2155721-A1 ORGANIC COMPOUNDS Novartis Ag (CH) 2010-02-24 EP claimed
EP-2074089-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2009-07-01 EP claimed
WO-2008135557-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-11-13 WO claimed
WO-2008048991-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-04-24 WO claimed
US-20070079392-A1 Human G protein-coupled receptors and modulators thereof for the treatment of metabolic-related disorders ARENA PHARMACEUTICALS, INC. (US) 2007-04-05 US claimed
US-20060276496-A1 Anti-Cytokine Heterocyclic Compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2006-12-07 US claimed
US-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders PFIZER, INC. 2005-05-19 US claimed
US-20050004178-A1 Human G protein-coupled receptors and modulators thereof for the treatment of metabolic-related disorders ARENA PHARMACEUTICALS, INC. (US) 2005-01-06 US claimed
US-20040142377-A1 Human G protein-coupled receptors and modulators thereof for the treatment of metabolic-related disorders ARENA PHARMACEUTICALS, INC. (US) 2004-07-22 US claimed
US-20040110778-A1 Heterocyclic compounds as ligands of the GABAA receptor YOHANNES DANIEL (US) 2004-06-10 US claimed
EP-1325006-A2 HETEROCYCLIC COMPOUNDS AS LIGANDS OF THE GABA A? RECEPTOR NEUROGEN CORPORATION (US) 2003-07-09 EP claimed
US-20030105081-A1 Heterocyclic compounds as ligands of the GABAA receptor PFIZER INC 2003-06-05 US claimed
WO-2002012442-A2 HETEROCYCLIC COMPOUNDS AS LIGANDS OF THE GABAA RECEPTOR NEUROGEN CORPORATION (US) 2002-02-14 WO claimed
US-12612388-B2 Receptor-interacting protein 1 inhibitors including piperazine heterocyclic amide ureas Sironax Ltd. (KY) 2026-04-28 US disclosed
US-6653471-B2 Tricyclic heteroaromatic compounds containing pyrrole ring; central nervous system disorder treatment; side effect reduction NEUROGEN CORPORATION 2003-11-25 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 (9 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-20030105081-A1 Heterocyclic compounds as ligands of the GABAA receptor GABRB1, GABRP, GABRA1 SIRT6 2421/4885LMNA 3137/4885ADORA3 188/4885
US-20070079392-A1 Human G protein-coupled receptors and modulators thereof for the treatment of metabolic-related disorders GPR119, ADIPOR2, GCGR SIRT6 731/4885LMNA 1752/4885ADORA3 130/4885
US-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders APP, BACE1, SNCA SIRT6 750/4885LMNA 1292/4885ADORA3 92/4885
US-20060276496-A1 Anti-Cytokine Heterocyclic Compounds MAPKAPK2, MAP4K2, MAP3K2 SIRT6 781/4885LMNA 2542/4885ADORA3 4680/4885
US-20100190773-A1 Anti-Cytokine Heterocyclic Compounds MAPKAPK2, MAP4K2, MAP3K2 SIRT6 781/4885LMNA 2542/4885ADORA3 4680/4885
US-20040110778-A1 Heterocyclic compounds as ligands of the GABAA receptor GABRB1, GABRP, GABRA1 SIRT6 2421/4885LMNA 3137/4885ADORA3 188/4885
US-12612388-B2 Receptor-interacting protein 1 inhibitors including piperazine heterocyclic amide ureas NCOR1, NCOR2, SUCNR1 SIRT6 2737/4885LMNA 2800/4885ADORA3 2959/4885
US-20050004178-A1 Human G protein-coupled receptors and modulators thereof for the treatment of metabolic-related disorders GPR119, ADIPOR2, GCGR SIRT6 731/4885LMNA 1752/4885ADORA3 130/4885
US-20040142377-A1 Human G protein-coupled receptors and modulators thereof for the treatment of metabolic-related disorders GPR119, ADIPOR2, GCGR SIRT6 731/4885LMNA 1752/4885ADORA3 130/4885

“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.