SCHEMBL8696982

SCHEMBL8696982

CN(CCCN)CCN(C)CCC(N=C=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.33

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
SCHEMBL8696977 0.70 CHRM2 (0.34) CHRM2
SCHEMBL25443482 0.65 CHRM2 (0.72) CHRM2
SCHEMBL4805968 0.65 CHRM2 (0.72) CHRM2
SCHEMBL15594 0.62 CHRM2 (0.77) CHRM2
SCHEMBL11587714 0.62 CHRM2 (0.77) CHRM2
SCHEMBL8696093 0.62 CHRM2 (0.45) CHRM2
SCHEMBL10525172 0.62 CYP1A2 (0.37)
SCHEMBL9945685 0.62 CHRM2 (0.54) CHRM2
SCHEMBL12589253 0.62 CHRM2 (0.54) CHRM2
SCHEMBL7775532 0.61 CHRM2 (0.39) CHRM2

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-5804559-A WATER SOLUBILITY HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-08 US disclosed