SCHEMBL6375598

SCHEMBL6375598

N#Cc1nc(F)cnc1N

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 10/20 0.42
FEN1 P39748 10/20 0.42
CSNK1A1 P48729 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
HTT P42858 1/20 0.37
KHK P50053 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
USP8 P40818 1/20 0.34
PIK3CD O00329 2/20 0.34
PIK3R1 P27986 1/20 0.34

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
SCHEMBL1338236 0.78 CYP11B2 (0.33)
SCHEMBL7781784 0.78 USP8 (0.40) ALOX5APFEN1CSNK1A1CLK4HTT
SCHEMBL29379576 0.78 CYP11B2 (0.33)
SCHEMBL1697950 0.77 CSNK1A1 (0.38) ALOX5APFEN1CSNK1A1CLK4HTT
SCHEMBL618039 0.77 HTT (0.47) ALOX5APFEN1CSNK1A1CLK4HTT
SCHEMBL12466671 0.75 CSNK1A1 (0.37) ALOX5APFEN1CSNK1A1CLK4HTT
SCHEMBL9195651 0.75 KDM4E (0.41) ALOX5APFEN1CSNK1A1CLK4HTT
SCHEMBL6376942 0.75 ALDH1A1 (0.36) CSNK1A1CLK4KHK
SCHEMBL13346128 0.75 CSNK1A1 (0.37) ALOX5APFEN1CSNK1A1CLK4HTT
SCHEMBL1336348 0.75 ALOX5AP (0.31) ALOX5APFEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100390153-C Intermediate for producing novel pyrazine derivatives TOYAMA CHEMICAL CO LTD (JP) 2008-05-28 CN disclosed
CN-1781911-A Intermediate for producing novel pyrazine derivatives TOYAMA CHEMICAL CO LTD (JP) 2006-06-07 CN disclosed
CN-1239511-C Novel pyrazine derivative or salt thereof, and pharmaceutical composition containing the same TOYAMA CHEMICAL CO LTD (JP) 2006-02-01 CN disclosed
EP-1295890-B1 Novel pyrazine derivatives or salts thereof, pharmaceutical composition containing the same, and production intermediates thereof TOYAMA CHEMICAL CO LTD (JP) 2005-04-27 EP disclosed
EP-1256588-B1 NOVEL PYRAZINE DERIVATIVES OR SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THE DERIVATIVES OR THE SALTS AND INTERMEDIATES FOR THE PREPARATION OF BOTH TOYAMA CHEMICAL CO LTD (JP) 2005-02-02 EP disclosed
US-6800629-B2 VIRICIDES TOYAMA CHEMICAL CO., LTD. (JP) 2004-10-05 US disclosed
US-20030130213-A1 Novel pyrazine derivatives or salts thereof, pharmaceutical composition containing the same, and production intermediates thereof TOYAMA CHEMICAL CO., LTD. (JP) 2003-07-10 US disclosed
CN-1418220-A Novel pyrazine derivative or salt thereof, pharmaceutical composition containing same, and intermediate for producing both TOYAMA CHEMICAL CO LTD (JP) 2003-05-14 CN disclosed
EP-1295890-A1 Novel pyrazine derivatives or salts thereof, pharmaceutical composition containing the same, and production intermediates thereof TOYAMA CHEMICAL CO., LTD. (JP) 2003-03-26 EP disclosed
EP-1256588-A1 NOVEL PYRAZINE DERIVATIVES OR SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THE DERIVATIVES OR THE SALTS AND INTERMEDIATES FOR THE PREPARATION OF BOTH TOYAMA CHEMICAL CO., LTD. (JP) 2002-11-13 EP 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-20030130213-A1 Novel pyrazine derivatives or salts thereof, pharmaceutical composition containing the same, and production intermediates thereof GTF3C5, EIF2AK2, GTF3C2 ALOX5AP 2625/4885FEN1 3455/4885CSNK1A1 535/4885

“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.