SCHEMBL968342

SCHEMBL968342

Cn1nnnc1/C(=N/O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GFER P55789 2/20 0.41
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HSP90AA1 P07900 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPK14 Q16539 1/20 0.37
POLB P06746 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
XBP1 P17861 1/20 0.36
HIF1A Q16665 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
HSD11B1 P28845 2/20 0.33

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
SCHEMBL3328603 1.00 HPGD (0.41) HPGDALDH1A1GFERMAPTL3MBTL1
SCHEMBL968344 1.00 HPGD (0.41) HPGDALDH1A1GFERMAPTL3MBTL1
SCHEMBL30698221 0.89 HPGD (0.38) HPGDALDH1A1GFERMAPTL3MBTL1
SCHEMBL22163777 0.87 ALDH1A1 (0.42) HPGDALDH1A1GFERMAPTHTT
SCHEMBL16093550 0.87 HTT (0.41) HPGDALDH1A1MAPTL3MBTL1HTT
SCHEMBL4684160 0.85 ALDH1A1 (0.39) HPGDALDH1A1MAPTL3MBTL1HTT
SCHEMBL4684225 0.84 ALDH1A1 (0.40) ALDH1A1GFERRAB9APOLBNPSR1
SCHEMBL4680198 0.84 LMNA (0.40) HPGDALDH1A1MAPTHTTKDM4E
SCHEMBL14505563 0.83 LMNA (0.38) ALDH1A1MAPTL3MBTL1GAARAB9A
SCHEMBL14641805 0.82 DRD4 (0.39) HPGDALDH1A1MAPTL3MBTL1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2826773-B1 COMPOUND, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PURIFYING COMPOUND NIPPON SODA CO (JP) 2016-11-02 EP disclosed
US-9212152-B2 Process for the preparation of N-hydroxy-1-(1-alkyl-1H-tetrazol-5-yl)-1-phenylmethanimine derivatives BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-15 US disclosed
EP-2812318-B1 PROCESS FOR THE PREPARATION OF N-HYDROXY-1-(1-ALKYL-1H-TETRAZOL-5-YL)-1-PHENYLMETHANIMINE DERIVATIVES BAYER IP GMBH (DE) 2015-10-28 EP disclosed
US-20150299145-A1 PROCESS FOR THE PREPARATION OF N-HYDROXY-1-(1-ALKYL-1H-TETRAZOL-5-YL)-1-PHENYLMETHANIMINE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-10-22 US disclosed
EP-2812318-A1 PROCESS FOR THE PREPARATION OF N-HYDROXY-1-(1-ALKYL-1H-TETRAZOL-5-YL)-1-PHENYLMETHANIMINE DERIVATIVES Bayer Intellectual Property GmbH (DE) 2014-12-17 EP disclosed
US-8614217-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2013-12-24 US disclosed
US-8557849-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2013-10-15 US disclosed
WO-2013117582-A1 PROCESS FOR THE PREPARATION OF N-HYDROXY-1-(1-ALKYL-1H-TETRAZOL-5-YL)-1-PHENYLMETHANIMINE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-08-15 WO disclosed
US-8466176-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2013-06-18 US disclosed
EP-2257168-B1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES BAYER IP GMBH (DE) 2013-06-05 EP disclosed
US-20110201613-A1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2011-08-18 US disclosed
US-20110105566-A1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2011-05-05 US disclosed
US-20110021572-A1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2011-01-27 US disclosed
US-20110015236-A1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2011-01-20 US disclosed
EP-2265118-A2 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES Bayer CropScience AG (DE) 2010-12-29 EP disclosed
WO-2009115557-A2 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2009-09-24 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 (5 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-20110015236-A1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES CYP51A1, HAAO, HPD HPGD 1207/4885ALDH1A1 2344/4885GFER 1091/4885
US-20110201613-A1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES HPD, HAAO, CYP8B1 HPGD 452/4885ALDH1A1 2708/4885GFER 948/4885
US-20110105566-A1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES HAAO, CYP51A1, HPD HPGD 2035/4885ALDH1A1 3321/4885GFER 1202/4885
US-20110021572-A1 FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES HAAO, CYP51A1, HPD HPGD 2035/4885ALDH1A1 3321/4885GFER 1202/4885
US-20150299145-A1 PROCESS FOR THE PREPARATION OF N-HYDROXY-1-(1-ALKYL-1H-TETRAZOL-5-YL)-1-PHENYLMETHANIMINE DERIVATIVES HNMT, PNMT, TPH1 HPGD 122/4885ALDH1A1 96/4885GFER 3363/4885

“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.