SCHEMBL13530476

SCHEMBL13530476

COc1ccc(COc2ncc(F)c(NC(=S)Nc3ccccc3F)n2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.49
LMNA P02545 4/20 0.48
KMT2A Q03164 4/20 0.48
GAA P10253 3/20 0.48
ALDH1A1 P00352 6/20 0.44
RAB9A P51151 3/20 0.43
MEN1 O00255 3/20 0.43
NPC1 O15118 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
MAPK1 P28482 2/20 0.41
MAPT P10636 2/20 0.39
MAPK10 P53779 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CSF1R P07333 1/20 0.38
ALOX12 P18054 1/20 0.38

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
SCHEMBL13530179 0.89 PPIF (0.48) HPGDLMNAKMT2AGAAALDH1A1
SCHEMBL13530335 0.86 RAB9A (0.53) HPGDLMNAKMT2AGAAALDH1A1
SCHEMBL13529404 0.86 KMT2A (0.43) HPGDLMNAKMT2AALDH1A1MEN1
SCHEMBL13529700 0.85 HPGD (0.55) HPGDLMNAKMT2AGAAALDH1A1
SCHEMBL13530483 0.85 ALDH1A1 (0.46) HPGDKMT2AALDH1A1RAB9AMEN1
SCHEMBL13529496 0.85 ALDH1A1 (0.47) HPGDKMT2AALDH1A1RAB9AMEN1
SCHEMBL13530216 0.85 CYP1A2 (0.47) HPGDLMNAKMT2AGAAALDH1A1
SCHEMBL13529721 0.84 PPIF (0.46) HPGDLMNAKMT2AGAAALDH1A1
SCHEMBL13529568 0.83 LMNA (0.39) HPGDLMNAKMT2AGAAALDH1A1
SCHEMBL17011520 0.82 LMNA (0.36) HPGDLMNAKMT2AALDH1A1RAB9A

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
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
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 HPGD 3992/4885LMNA 4636/4885KMT2A 3037/4885
US-20140024616-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 HPGD 3992/4885LMNA 4636/4885KMT2A 3037/4885
US-20090203647-A1 5-FLUORO PYRIMIDINE DERIVATIVES DPYD, DPM1, DDX5 HPGD 3992/4885LMNA 4636/4885KMT2A 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.