SCHEMBL239263

SCHEMBL239263

CN(C)CCOc1ncccc1O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.50
CHRNA4 P43681 2/20 0.50
HSD17B10 Q99714 1/20 0.44
KAT2B Q92831 1/20 0.42
HTR7 P34969 4/20 0.41
LTA4H P09960 2/20 0.41
CHRM2 P08172 1/20 0.40
GRM4 Q14833 1/20 0.40
HTT P42858 1/20 0.40
HTR1B P28222 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL6998387 0.83 F2 (0.44) CHRNB2CHRNA4HSD17B10ALDH1A1L3MBTL1
SCHEMBL19597443 0.81 CHRNB2 (0.51) CHRNB2CHRNA4KAT2BHTR7LTA4H
SCHEMBL12754891 0.80 KDM4E (0.45) HSD17B10LTA4HGRM4HTTALDH1A1
SCHEMBL1509521 0.80 CHRNB2 (0.47) CHRNB2CHRNA4KAT2BHTR7LTA4H
SCHEMBL16334317 0.79 CHRNB2 (0.50) CHRNB2CHRNA4KAT2BHTR7LTA4H
SCHEMBL323831 0.78 ALDH1A1 (0.48) HSD17B10GRM4HTTALDH1A1L3MBTL1
SCHEMBL238407 0.78 HTR7 (0.53) CHRNB2CHRNA4KAT2BHTR7HTR1B
SCHEMBL28311734 0.76 KDM4E (0.49) CHRM2ALDH1A1
SCHEMBL238514 0.76 ALDH1A1 (0.49) HSD17B10HTTALDH1A1L3MBTL1
SCHEMBL29174339 0.73 GRM4 (0.41) CHRM2GRM4HTTALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140329826-A1 (2R)-1-(3-CHLORO-2-PYRAZINYL)-2-METHYLPIPERAZINE AND SALTS THEREOF PROXIMAGEN LIMITED (GB) 2014-11-06 US disclosed
US-8835439-B2 Pharmaceutical composition containing (2R)-methyl-1-3-[2-(3-pyridinyloxy)ethoxy]-2-pyrazinylpiperazine L-malate for treatment of serotonin-related diseases PROXIMAGEN LIMITED (GB) 2014-09-16 US disclosed
US-20130158266-A1 (2R)-1-(3-Chloro-2-Pyrazinyl)-2-Methylpiperazine And Salts Thereof BIOVITRUM AB (PUBL) (SE) 2013-06-20 US disclosed
US-8410113-B2 (2R)-1-(3-chloro-2-pyrazinyl)-2-methylpiperazine and salts thereof BIOVITRUM AB (PUBL) (SE) 2013-04-02 US disclosed
US-20120010410-A1 (2R)-1-(3-CHLORO-2-PYRAZINYL)-2-METHYLPIPERAZINE AND SALTS THEREOF BIOVITRUM AB, A SWEDEN CORPORATION 2012-01-12 US disclosed
US-20120004241-A1 SUCCINATE SALT OF (2R)-METHYL-1-PIPERAZINE BIOVITRUM AB, A SWEDEN CORPORATION 2012-01-05 US disclosed
US-8030316-B2 Malate salt of (2R)-methyl-1-{3-[2-(3-pyridinyloxy)ethoxy]-2-pyrazinyl}piperazine BIOVITRUM AB (PUBL) (SE) 2011-10-04 US disclosed
US-7820677-B2 Phosphoric acid addition salt of (2R)-1-[3-(2-{[2-(2-dimethylaminoethoxy)-3-pyridinyl]oxy}-ethoxy)-2-pyrazinyl]-2-methylpiperazine PROXIMAGEN NEUROSCIENCE PLC (GB) 2010-10-26 US disclosed
US-20100256374-A1 NOVEL PROCESS BIOVITRUM AB, A SWEDEN CORPORATION 2010-10-07 US disclosed
EP-1645558-B1 Piperazinylpyrazines as serotonin 5-HT2C receptor modulators BIOVITRUM AB PUBL (SE) 2008-06-11 EP disclosed
US-7129354-B2 Process for the preparation of stable acid addition salt of 2,3-disubstituted pyrazine compounds BIOVITRUM AB (SE) 2006-10-31 US disclosed
EP-1529043-B1 Process for the preparation of 2-methyl piperazine derivatives. BIOVITRUM AB (SE) 2006-08-02 EP disclosed
US-20060142578-A1 Novel process BIOVITRUM AB, A SWEDEN CORPORATION 2006-06-29 US disclosed
EP-1645558-A1 Piperazinylpyrazines as serotonin 5-HT2C receptor modulators BIOVITRUM AB (SE) 2006-04-12 EP disclosed
EP-1529043-A1 NOVEL PROCESS Biovitrum AB (SE) 2005-05-11 EP disclosed
US-20040038981-A1 Novel Process PROXIMAGEN NEUROSCIENCE PLC (GB) 2004-02-26 US disclosed
WO-2004000829-A1 NOVEL PROCESS BIOVITRUM AB (SE) 2003-12-31 WO 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 (7 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-20120004241-A1 SUCCINATE SALT OF (2R)-METHYL-1-PIPERAZINE SUCNR1, HTR5A, HTR2C CHRNB2 1029/4885CHRNA4 572/4885HSD17B10 419/4885
US-20100256374-A1 NOVEL PROCESS HTR1A, TPH1, HTR5A CHRNB2 240/4885CHRNA4 140/4885HSD17B10 398/4885
US-20130158266-A1 (2R)-1-(3-Chloro-2-Pyrazinyl)-2-Methylpiperazine And Salts Thereof HTR2C, HTR5A, HTR2A CHRNB2 252/4885CHRNA4 187/4885HSD17B10 732/4885
US-20040038981-A1 Novel Process HTR1A, TPH1, HTR1B CHRNB2 258/4885CHRNA4 115/4885HSD17B10 373/4885
US-20060142578-A1 Novel process HTR1A, TPH1, HTR5A CHRNB2 216/4885CHRNA4 140/4885HSD17B10 480/4885
US-20120010410-A1 (2R)-1-(3-CHLORO-2-PYRAZINYL)-2-METHYLPIPERAZINE AND SALTS THEREOF HTR2C, HTR5A, HTR2A CHRNB2 252/4885CHRNA4 187/4885HSD17B10 732/4885
US-20140329826-A1 (2R)-1-(3-CHLORO-2-PYRAZINYL)-2-METHYLPIPERAZINE AND SALTS THEREOF HTR2C, HTR5A, HTR2A CHRNB2 252/4885CHRNA4 187/4885HSD17B10 732/4885

“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.