SCHEMBL1448418

SCHEMBL1448418

CN(C)C=Nc1nc(=O)[nH]cc1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KMT2A Q03164 6/20 0.35
MEN1 O00255 5/20 0.35
ALOX15 P16050 1/20 0.33
RECQL P46063 1/20 0.33
POLB P06746 3/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 4/20 0.32
MAPT P10636 4/20 0.32
ALDH1A1 P00352 2/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HSD17B10 Q99714 2/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
HBB P68871 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NPC1 O15118 2/20 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
SCHEMBL1448414 1.00 LMNA (0.36) LMNAL3MBTL1KMT2AMEN1ALOX15
SCHEMBL5694243 0.82 LMNA (0.37) LMNAL3MBTL1KMT2AMEN1ALOX15
SCHEMBL5694245 0.82 LMNA (0.37) LMNAL3MBTL1KMT2AMEN1ALOX15
SCHEMBL14104713 0.81 LMNA (0.36) LMNAL3MBTL1KMT2AMEN1ALOX15
SCHEMBL27266513 0.69 ALDH1A1 (0.31) LMNAMAPTALDH1A1HTTHBB
SCHEMBL12104174 0.69
Water SCHEMBL28300312 0.68 ALDH1A1 (0.31) LMNAMAPTALDH1A1HTTHBB
Water SCHEMBL27589624 0.68 ALDH1A1 (0.31) LMNAMAPTALDH1A1HTTHBB
SCHEMBL1448444 0.67 MEN1 (0.35) LMNAKMT2AMEN1ALOX15RECQL
SCHEMBL1448445 0.67 MEN1 (0.35) LMNAKMT2AMEN1ALOX15RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170008855-A1 5-FLUOROPYRIMIDINONE DERIVATIVES ADAMA MAKHTESHIM LTD. (IL) 2017-01-12 US disclosed
US-20150111851-A1 5-FLUOROPYRIMIDINONE DERIVATIVES ADAMA MAKHTESHIM LTD. (IL) 2015-04-23 US disclosed
US-8916579-B2 5-fluoropyrimidinone derivatives DOW AGROSCIENCES, LLC. (US) 2014-12-23 US disclosed
US-20110053891-A1 5-FLUOROPYRIMIDINONE DERIVATIVES DOW AGROSCIENCES LLC (US) 2011-03-03 US 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-20170008855-A1 5-FLUOROPYRIMIDINONE DERIVATIVES DDT, CASP5, CYP3A5 LMNA 4528/4885L3MBTL1 1489/4885KMT2A 3314/4885
US-20150111851-A1 5-FLUOROPYRIMIDINONE DERIVATIVES DDT, CASP5, CYP3A5 LMNA 4528/4885L3MBTL1 1489/4885KMT2A 3314/4885
US-20110053891-A1 5-FLUOROPYRIMIDINONE DERIVATIVES DDT, CASP5, CYP3A5 LMNA 4528/4885L3MBTL1 1489/4885KMT2A 3314/4885

“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.