SCHEMBL6375917

SCHEMBL6375917

COC(=O)c1nc(F)c[nH]c1=O

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.45
ERCC1 P07992 2/20 0.39
FEN1 P39748 2/20 0.39
ERCC4 Q92889 2/20 0.39
KDM4E B2RXH2 6/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
RAB9A P51151 1/20 0.37
RNASEH1 O60930 1/20 0.37
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4C Q9H3R0 1/20 0.35
STAT3 P40763 1/20 0.35
HIF1A Q16665 1/20 0.35
GLA P06280 1/20 0.34
GAA P10253 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
SCHEMBL9682981 0.79 NPSR1 (0.45) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL6382584 0.79 NPSR1 (0.45) NPSR1ERCC1FEN1ERCC4KDM4E
Favipiravir SCHEMBL6378032 0.77 ERCC1 (0.32) ERCC1FEN1ERCC4
SCHEMBL6380750 0.76 NPSR1 (0.41) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL19207970 0.71 NPSR1 (0.46) NPSR1KDM4EALDH1A1SMN1; SMN2RAB9A
SCHEMBL15093907 0.69 NPSR1 (0.50) NPSR1KDM4EALDH1A1SMN1; SMN2RAB9A
SCHEMBL22139856 0.69 HPGD (0.46) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL1946585 0.68 KDM4E (0.50) NPSR1ERCC1FEN1ERCC4KDM4E
SCHEMBL6376308 0.68 NPSR1 (0.48) NPSR1KDM4EALDH1A1SMN1; SMN2RAB9A
SCHEMBL16631730 0.68 NPSR1 (0.48) NPSR1KDM4EALDH1A1SMN1; SMN2RAB9A

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 NPSR1 3303/4885ERCC1 4799/4885FEN1 3455/4885

“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.