SCHEMBL3288204

SCHEMBL3288204

C#CCOc1c(F)cc(C(=O)NC(C)(C)C(C)C)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAPK1 P28482 1/20 0.39
CYP2B6 P20813 1/20 0.37
HTR2A P28223 3/20 0.36
DRD2 P14416 1/20 0.36
DRD1 P21728 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX12 P18054 1/20 0.36
HTR1A P08908 3/20 0.35
HTR7 P34969 3/20 0.35
HTR6 P50406 3/20 0.35
SLC6A5 Q9Y345 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
TUBB1 Q9H4B7 1/20 0.35
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL3289636 0.92 HTT (0.53) HTTL3MBTL1MAPK1CYP2B6HTR2A
SCHEMBL3286631 0.91 HTT (0.38) HTTL3MBTL1MAPTNPC1RAB9A
SCHEMBL3289408 0.85 MAPK1 (0.44) HTTL3MBTL1MAPK1CYP2B6ALDH1A1
SCHEMBL3309608 0.82 MAPK1 (0.46) HTTL3MBTL1MAPK1CYP2B6MEN1
SCHEMBL3288244 0.82 MAPK1 (0.46) HTTL3MBTL1MAPK1CYP2B6MEN1
SCHEMBL13325364 0.82 MAPK1 (0.46) HTTL3MBTL1MAPK1CYP2B6MEN1
SCHEMBL3285931 0.81 CYP2B6 (0.41) HTTMAPK1CYP2B6HTR2AALDH1A1
SCHEMBL3288060 0.81 CYP2B6 (0.51) HTTL3MBTL1MAPK1CYP2B6DRD2
SCHEMBL3285636 0.79 HTT (0.49) HTTL3MBTL1MAPK1CYP2B6HTR2A
SCHEMBL2292245 0.79 HTT (0.48) HTTL3MBTL1MAPK1CYP2B6KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7714168-B2 N-(1,1-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; N-(2,2-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-11 US disclosed
US-7714168-B2 N-(1,1-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; N-(2,2-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-11 US disclosed
US-7714168-B2 N-(1,1-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; N-(2,2-diemthylpropyl)-4-(2-propynyloxy)-3-methoxybenzamide; controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-11 US disclosed
EP-1940779-B1 AMIDE COMPOUNDS AND THEIR USE SUMITOMO CHEMICAL CO (JP) 2009-07-22 EP disclosed
US-20080319080-A1 Amide Compounds and Their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-12-25 US disclosed
US-20080319080-A1 Amide Compounds and Their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-12-25 US disclosed
US-20080319080-A1 Amide Compounds and Their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-12-25 US disclosed
EP-1940779-A2 AMIDE COMPOUNDS AND THEIR USE Sumitomo Chemical Company, Limited (JP) 2008-07-09 EP disclosed
WO-2007049729-A2 AMIDE COMPOUNDS AND THEIR USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-03 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 (1 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-20080319080-A1 Amide Compounds and Their Use NAT1, ACAT2, NAAA HTT 1696/4885L3MBTL1 1117/4885MAPK1 1663/4885

“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.