SCHEMBL3288140

SCHEMBL3288140

C#CCOc1ccc(C(=O)NC(C)CCC)cc1F

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 8/20 0.56
TAS1R1 Q7RTX1 8/20 0.56
ALDH1A1 P00352 4/20 0.54
HPGD P15428 1/20 0.54
RAB9A P51151 3/20 0.49
PPARG P37231 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 2/20 0.46
HTR2A P28223 1/20 0.43
CYP2B6 P20813 1/20 0.41
MLYCD O95822 1/20 0.40
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
NAMPT P43490 1/20 0.40

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
SCHEMBL14538323 0.92 MLYCD (0.51) TAS1R3TAS1R1ALDH1A1HPGDRAB9A
SCHEMBL3286567 0.86 RAB9A (0.66) TAS1R3TAS1R1ALDH1A1HPGDRAB9A
SCHEMBL13325344 0.85 TAS1R3 (0.47) TAS1R3TAS1R1ALDH1A1RAB9ALMNA
SCHEMBL3285899 0.85 TAS1R3 (0.47) TAS1R3TAS1R1ALDH1A1RAB9ALMNA
SCHEMBL3288051 0.84 TAS1R3 (0.47) TAS1R3TAS1R1ALDH1A1LMNAHTR2A
SCHEMBL3310916 0.83 TAS1R3 (0.46) TAS1R3TAS1R1ALDH1A1LMNAHTR2A
SCHEMBL3286621 0.83 GRM5 (0.47) TAS1R3TAS1R1ALDH1A1LMNAHTR2A
SCHEMBL4252803 0.81 TAS1R3 (0.44) TAS1R3TAS1R1ALDH1A1HPGDLMNA
SCHEMBL3285897 0.80 KMT2A (0.49) TAS1R3TAS1R1ALDH1A1HPGDSMN1; SMN2
SCHEMBL4241636 0.79 KDM4E (0.44) TAS1R3TAS1R1ALDH1A1HPGDLMNA

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 TAS1R3 1969/4885TAS1R1 898/4885ALDH1A1 1785/4885

“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.