SCHEMBL3672651

SCHEMBL3672651

CN(Cc1ccc(Cl)nc1)/C(CC/C(=N\C#N)N(C)Cc1ccc(Cl)nc1)=N/C#N

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
CHRNA7 P36544 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
FFAR1 O14842 1/20 0.36
AR P10275 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL9889722 0.91 CHRNB2 (0.38) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
SCHEMBL7636278 0.86 CHRNB2 (0.40) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
Acetamiprid SCHEMBL29352485 0.85 ALDH1A1 (0.41) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
Acetamiprid SCHEMBL13448458 0.85 ALDH1A1 (0.41) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
Acetamiprid SCHEMBL26296 0.85 ALDH1A1 (0.41) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
Acetamiprid SCHEMBL15757338 0.85 ALDH1A1 (0.41) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
Acetamiprid SCHEMBL237310 0.85 ALDH1A1 (0.41) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
Acetamiprid SCHEMBL29364947 0.85 ALDH1A1 (0.41) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
SCHEMBL7768115 0.84 CHRNB2 (0.37) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7
SCHEMBL7768113 0.84 CHRNB2 (0.37) CHRNB2CHRNA4ALDH1A1MEN1CHRNA7

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
US-20100227897-A1 Composition for Controlling Colorado Potato Beetles FMC CORPORATION (US) 2010-09-09 US disclosed