SCHEMBL13530346

SCHEMBL13530346

COc1ccc(Oc2ncc(F)c(NC(C)=O)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
MAPK8 P45983 1/20 0.47
MAPK10 P53779 1/20 0.47
AURKA O14965 3/20 0.45
SYK P43405 1/20 0.45
ALDH1A1 P00352 6/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 2/20 0.42
RAB9A P51151 1/20 0.42
ACACB O00763 1/20 0.42
CYP1A2 P05177 3/20 0.41
CYP3A4 P08684 3/20 0.41
CLK4 Q9HAZ1 2/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 2/20 0.41
ADORA3 P0DMS8 3/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL13530368 0.83 ALDH1A1 (0.50) SMN1; SMN2MAPK8MAPK10AURKASYK
SCHEMBL13730059 0.81 SMN1; SMN2 (0.41) SMN1; SMN2MAPK8MAPK10AURKASYK
SCHEMBL13529468 0.80 AURKA (0.46) SMN1; SMN2MAPK8MAPK10AURKASYK
SCHEMBL13729358 0.79 SYK (0.45) SMN1; SMN2MAPK8MAPK10AURKASYK
SCHEMBL13530439 0.78 POLB (0.45) SMN1; SMN2MAPK8MAPK10ALDH1A1POLB
SCHEMBL13750883 0.77 FPR2 (0.38) MAPK8MAPK10AURKASYKALDH1A1
SCHEMBL13530237 0.77 PIK3CA (0.52) AURKASYKALDH1A1RAB9ACYP1A2
SCHEMBL13750582 0.76 MAPK8 (0.42) MAPK8SYKMEN1KMT2ALMNA
SCHEMBL17012477 0.75 AURKA (0.44) SMN1; SMN2MAPK8MAPK10AURKASYK
SCHEMBL13529833 0.75 PRKCB (0.45) SYKACACBMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9204653-B2 5-fluoro pyrimidine derivatives DOW AGROSCIENCES LLC (US) 2015-12-08 US disclosed
US-9204653-B2 5-fluoro pyrimidine derivatives DOW AGROSCIENCES LLC (US) 2015-12-08 US disclosed
US-9174970-B2 5-fluoro pyrimidine derivatives DOW AGROSCIENCES LLC (US) 2015-11-03 US disclosed
US-9174970-B2 5-fluoro pyrimidine derivatives DOW AGROSCIENCES LLC (US) 2015-11-03 US disclosed
EP-2252594-B1 4-AMINO-5-FLUORO-PYRIMIDINE DERIVATIVES AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2015-08-19 EP disclosed
US-20140024616-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2014-01-23 US disclosed
US-20140024616-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2014-01-23 US disclosed
US-20100022538-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2010-01-28 US disclosed
US-20090203647-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2009-08-13 US disclosed
US-20090203647-A1 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2009-08-13 US disclosed
WO-2009094442-A2 5-FLUORO PYRIMIDINE DERIVATIVES DOW AGROSCIENCES LLC (US) 2009-07-30 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 (3 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-20100022538-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 SMN1; SMN2 2803/4885MAPK8 2308/4885MAPK10 3444/4885
US-20140024616-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 SMN1; SMN2 2803/4885MAPK8 2308/4885MAPK10 3444/4885
US-20090203647-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 SMN1; SMN2 2803/4885MAPK8 2308/4885MAPK10 3444/4885

“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.