SCHEMBL18965339

SCHEMBL18965339

CO/N=C/C1CCN(C(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
HRH3 Q9Y5N1 6/20 0.32
CHRNA7 P36544 1/20 0.31

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
SCHEMBL21037482 0.78 CHRM2 (0.43) CHRM2CHRM4CHRM1CHRM3
SCHEMBL12756945 0.76
SCHEMBL213818 0.72
SCHEMBL25783904 0.72
SCHEMBL213091 0.70 CHRM2 (0.38) CHRM2CHRM4CHRM1CHRM3
SCHEMBL213092 0.70 CHRM2 (0.38) CHRM2CHRM4CHRM1CHRM3
SCHEMBL213508 0.70 CHRM2 (0.38) CHRM2CHRM4CHRM1CHRM3
SCHEMBL214804 0.70 CHRM2 (0.38) CHRM2CHRM4CHRM1CHRM3
SCHEMBL212281 0.70 CHRM2 (0.38) CHRM2CHRM4CHRM1CHRM3
SCHEMBL212282 0.70 CHRM2 (0.38) CHRM2CHRM4CHRM1CHRM3

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
WO-2017097927-A1 PESTICIDALLY ACTIVE 1,2,4-TRIAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-06-15 WO disclosed