SCHEMBL7122663

SCHEMBL7122663

C=CCOC(=O)n1cc(F)c(N)nc1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ALB P02768 1/20 0.34
EP300 Q09472 4/20 0.34
NPSR1 Q6W5P4 1/20 0.33
CYP3A4 P08684 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
RAB9A P51151 1/20 0.31
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31

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
SCHEMBL5694117 0.84 SMN1; SMN2 (0.37) ALDH1A1TSHRHSD17B10EP300NPSR1
SCHEMBL7062249 0.80 ALB (0.35) ALBEP300POLG
SCHEMBL12883801 0.78 ALB (0.34) ALBEP300POLG
SCHEMBL12883799 0.78 EP300 (0.39) ALDH1A1TSHRHSD17B10ALBEP300
SCHEMBL12883796 0.77 EP300 (0.36) ALBEP300
SCHEMBL1223628 0.76 KDM4E (0.41) ALDH1A1NPSR1SMN1; SMN2MAPK1RAB9A
SCHEMBL2470522 0.76 LMNA (0.39) ALDH1A1TSHRHSD17B10EP300CYP3A4
SCHEMBL1224511 0.76 ALB (0.34) ALBEP300
SCHEMBL5694138 0.75 NPSR1 (0.40) ALDH1A1TSHRHSD17B10ALBNPSR1
SCHEMBL27798766 0.73 ALB (0.39) ALBEP300POLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2462133-B1 5-FLUORO-2-OXOPYRIMIDINE- 1(2H)-CARBOXYLATE DERIVATIVES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2014-09-24 EP disclosed
US-8318758-B2 5-fluoro-2-oxopyrimidine-1(2H)-carboxylate derivatives DOW AGROSCIENCES, LLC (US) 2012-11-27 US disclosed
US-8318758-B2 5-fluoro-2-oxopyrimidine-1(2H)-carboxylate derivatives DOW AGROSCIENCES, LLC (US) 2012-11-27 US disclosed
US-20110034491-A1 5-FLUORO-2-OXOPYRIMIDINE- 1(2H)-CARBOXYLATE DERIVATIVES ADAMA MAKHTESHIM LTD. (IL) 2011-02-10 US disclosed
US-20110034491-A1 5-FLUORO-2-OXOPYRIMIDINE- 1(2H)-CARBOXYLATE DERIVATIVES ADAMA MAKHTESHIM LTD. (IL) 2011-02-10 US disclosed
WO-2011017544-A1 5-FLUORO-2-OXOPYRIMIDINE- 1(2H)-CARBOXYLATE DERIVATIVES DOW AGROSCIENCES LLC (US) 2011-02-10 WO disclosed
US-20030166606-A1 5'-deoxy-n-(substituted oxycarbonyl)-5-fluorocytosine and derivatives thereof, method of preparing same, and anticancer composition comprising same as active ingredients KOLON INDUSTRIES, INC. (KR) 2003-09-04 US disclosed
EP-1311524-A2 5'-DEOXY-N-(SUBSTITUTED OXYCARBONYL)-5-FLUOROCYTOSINE AND DERIVATIVES THEREOF, METHOD OF PREPARING SAME, AND ANTICANCER COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENTS Kolon Industries, Inc. (KR) 2003-05-21 EP disclosed
WO-2002011668-A2 5'-DEOXY-N-(SUBSTITUTED OXYCARBONYL)-5-FLUOROCYTOSINE AND DERIVATIVES THEREOF, METHOD OF PREPARING SAME, AND ANTICANCER COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENTS KOLON INDUSTRIES, INC. (KR) 2002-02-14 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 (2 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-20030166606-A1 5'-deoxy-n-(substituted oxycarbonyl)-5-fluorocytosine and derivatives thereof, method of preparing same, and anticancer composition comprising same as active ingredients DUT, RNGTT, MTAP ALDH1A1 1546/4885TSHR 4751/4885HSD17B10 4025/4885
US-20110034491-A1 5-FLUORO-2-OXOPYRIMIDINE- 1(2H)-CARBOXYLATE DERIVATIVES DDT, PFAS, CASP2 ALDH1A1 173/4885TSHR 3141/4885HSD17B10 3037/4885

“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.