SCHEMBL18156562

SCHEMBL18156562

CN(C(=O)c1ccc(C#N)cc1)c1cc(C(=O)Nc2c(Cl)cc(C(C)(F)C(F)(F)F)cc2C(F)(F)F)ccc1C#N

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AR P10275 7/20 0.37
HSD11B1 P28845 1/20 0.36
TRPA1 O75762 1/20 0.35
MLYCD O95822 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
PDK1 Q15118 1/20 0.35
PDK2 Q15119 1/20 0.35
PDK3 Q15120 1/20 0.35
PDK4 Q16654 1/20 0.35
ABCC9 O60706 1/20 0.35
ABCC8 Q09428 1/20 0.35
KCNJ11 Q14654 1/20 0.35
KCNJ8 Q15842 1/20 0.35
SLC2A1 P11166 1/20 0.34
SLC2A3 P11169 1/20 0.34
SLC2A4 P14672 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
SCHEMBL12355744 0.92 AR (0.36) ARHSD11B1TRPA1MLYCDMRGPRX4
SCHEMBL18156546 0.80 AR (0.39) ARMRGPRX4PDK1PDK2PDK3
SCHEMBL1767016 0.79 SIRT2 (0.41) TRPV1ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL1766316 0.75 VNN1 (0.35) HSD11B1TRPA1MLYCDTRPV1GPBAR1
SCHEMBL22402109 0.73 KCNQ3 (0.43) GPBAR1
SCHEMBL12649010 0.73 BRAF (0.43) GPBAR1
SCHEMBL1766625 0.73 SIRT2 (0.41) HSD11B1MLYCDTRPV1ABCC9ABCC8
SCHEMBL1767387 0.72 AR (0.37) ARMRGPRX4KCNJ11
SCHEMBL1766330 0.71 SIRT2 (0.39) MLYCDTRPV1ABCC9ABCC8KCNJ11
SCHEMBL1766466 0.71 RXFP1 (0.39) MLYCDGPBAR1PDK1PDK2PDK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3081552-A1 PEST CONTROL AGENT CONTAINING AN AMIDE DERIVATIVE AND USE OF THE PEST CONTROL AGENT Mitsui Chemicals Agro, Inc. (JP) 2016-10-19 EP disclosed