SCHEMBL767160

SCHEMBL767160

Nc1c(NC2CC2)ncnc1-c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 2/20 0.46
ADORA3 P0DMS8 1/20 0.45
ADORA2A P29274 1/20 0.45
ADORA1 P30542 1/20 0.45
AKT1 P31749 2/20 0.42
TP53 P04637 2/20 0.41
PAK1 Q13153 1/20 0.40
MAPT P10636 2/20 0.39
GRM5 P41594 1/20 0.39
GRM1 Q13255 1/20 0.39
IRAK4 Q9NWZ3 5/20 0.39
GRIN2B Q13224 1/20 0.38
HPGDS O60760 1/20 0.38
USP2 O75604 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
MAPK1 P28482 2/20 0.38
HSD17B10 Q99714 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
MEN1 O00255 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
SCHEMBL787083 0.85 ADORA3 (0.47) ADORA3ADORA2AADORA1TP53PAK1
SCHEMBL767164 0.76 HPGDS (0.42) MAP4K4TP53PAK1MAPTIRAK4
SCHEMBL31038592 0.72 KMT2A (0.41) TP53MAPTUSP2CYP1A2MAPK1
SCHEMBL31038591 0.72 KMT2A (0.41) TP53MAPTUSP2CYP1A2MAPK1
SCHEMBL4353155 0.71 MAP4K4 (0.79) MAP4K4IRAK4USP2CYP1A2CYP3A4
SCHEMBL21138338 0.70 HPGDS (0.47) MAP4K4ADORA1TP53PAK1HPGDS
SCHEMBL30808262 0.70 HPGDS (0.47) MAP4K4ADORA1TP53PAK1HPGDS
SCHEMBL21138485 0.70 CD38 (0.40) MAP4K4IRAK4HPGDSCYP3A4
SCHEMBL28890932 0.69 HPGDS (0.42) MAP4K4PAK1IRAK4HPGDSCYP3A4
SCHEMBL11617161 0.69 HPGDS (0.50) ADORA1TP53PAK1MAPTHPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102395570-B Aminopyrimidinamides as pest control agents BAYER CROPSCIENCE AG 2015-01-21 CN disclosed
EP-2398778-B1 AMINOPYRIDINEAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2014-03-26 EP disclosed
EP-2398778-B1 AMINOPYRIDINEAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2014-03-26 EP disclosed
US-8202877-B2 Aminopyrimidinamides as pesticides BAYER CROPSCIENCE AG (DE) 2012-06-19 US disclosed
US-8202877-B2 Aminopyrimidinamides as pesticides BAYER CROPSCIENCE AG (DE) 2012-06-19 US disclosed
US-8202877-B2 Aminopyrimidinamides as pesticides BAYER CROPSCIENCE AG (DE) 2012-06-19 US disclosed
US-20120071496-A1 Aminopyrimidinamides As Pest Control Agents BAYER CROPSCIENCE AG (DE) 2012-03-22 US disclosed
US-20120071496-A1 Aminopyrimidinamides As Pest Control Agents BAYER CROPSCIENCE AG (DE) 2012-03-22 US disclosed
US-20120071496-A1 Aminopyrimidinamides As Pest Control Agents BAYER CROPSCIENCE AG (DE) 2012-03-22 US disclosed
EP-2398778-A1 AMINOPYRIMIDINAMIDES AS PEST CONTROL AGENTS Bayer CropScience AG (DE) 2011-12-28 EP disclosed
US-20100298267-A1 AMINOPYRIMIDINAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (US) 2010-11-25 US disclosed
US-20100298267-A1 AMINOPYRIMIDINAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (US) 2010-11-25 US disclosed
US-20100298267-A1 AMINOPYRIMIDINAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (US) 2010-11-25 US disclosed
EP-2246335-A1 Aminopyridineamides as pesticides Bayer CropScience AG (DE) 2010-11-03 EP disclosed
EP-2246335-A1 Aminopyridineamides as pesticides Bayer CropScience AG (DE) 2010-11-03 EP disclosed
WO-2010094406-A1 AMINOPYRIMIDINAMIDES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-08-26 WO disclosed
WO-2010094406-A1 AMINOPYRIMIDINAMIDES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-08-26 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-20100298267-A1 AMINOPYRIMIDINAMIDES AS PESTICIDES DDT, NPEPPS, PTMS MAP4K4 1859/4885ADORA3 3147/4885ADORA2A 3520/4885
US-20120071496-A1 Aminopyrimidinamides As Pest Control Agents NPEPPS, DDT, DNPEP MAP4K4 1020/4885ADORA3 4231/4885ADORA2A 4107/4885

“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.