SCHEMBL4244880

SCHEMBL4244880

C#CCOc1c(F)cc(C(=O)NC2CC2)cc1F

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.42
CYP2C9 P11712 8/20 0.42
HPGD P15428 2/20 0.40
MAPK11 Q15759 3/20 0.40
MCHR1 Q99705 2/20 0.40
BUB1 O43683 1/20 0.39
PRKACG P22612 1/20 0.39
MAPKAPK2 P49137 1/20 0.39
ACSL5 Q9ULC5 1/20 0.39
STK24 Q9Y6E0 1/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
TAS1R2 Q8TE23 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
AR P10275 1/20 0.38
SMYD3 Q9H7B4 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
SCHEMBL4248764 0.95 MEN1 (0.46) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL4244964 0.95 MEN1 (0.43) MAPK14CYP2C9HPGDMEN1KMT2A
SCHEMBL4246203 0.94 TAS1R3 (0.48) MAPK14CYP2C9MAPK11TAS1R3TAS1R1
SCHEMBL4252966 0.94 MEN1 (0.48) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL4251504 0.85 CA12 (0.42) HPGDTAS1R3TAS1R1TAS1R2MEN1
SCHEMBL4241570 0.85 MEN1 (0.51) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL4249309 0.83 CNR1 (0.44) TAS1R3TAS1R1TAS1R2
SCHEMBL4242303 0.83 TAS1R3 (0.42) MAPK14CYP2C9TAS1R3TAS1R1TAS1R2
SCHEMBL4247557 0.83 TAS1R3 (0.42) TAS1R3TAS1R1TAS1R2
SCHEMBL4252793 0.83 CNR1 (0.42) TAS1R3TAS1R1TAS1R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902400-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) 2011-03-08 US disclosed
US-7902400-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) 2011-03-08 US disclosed
US-7902400-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) 2011-03-08 US disclosed
US-20090131531-A1 Amide Compounds and their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-21 US disclosed
US-20090131531-A1 Amide Compounds and their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-21 US disclosed
US-20090131531-A1 Amide Compounds and their Use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-21 US disclosed
EP-1940780-A1 AMIDE COMPOUNDS AND THEIR USE SUMITOMO CHEMICAL CO., LTD. (JP) 2008-07-09 EP disclosed
WO-2007049728-A1 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-20090131531-A1 Amide Compounds and their Use NAT1, ACAT2, NAAA MAPK14 2739/4885CYP2C9 1473/4885HPGD 2210/4885

“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.