SCHEMBL17699092

SCHEMBL17699092

O=C([O-])CC[n+]1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BCHE P06276 7/20 0.44
ACHE P22303 6/20 0.44

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
SCHEMBL699589 0.86 BCHE (0.52) BCHEACHE
SCHEMBL314127 0.80 BCHE (0.48) BCHEACHE
Butyric Acid SCHEMBL2788853 0.78 CHRM2 (0.55) ACHE
Hydrochloric Acid SCHEMBL5315062 0.78 BCHE (0.46) BCHEACHE
SCHEMBL10604457 0.76 BCHE (0.44) BCHEACHE
Cetylpyridinium SCHEMBL14320892 0.76 CHRM2 (0.67) ACHE
Octanoic Acid SCHEMBL16009078 0.76 CHRM2 (0.61) ACHE
Cetylpyridinium SCHEMBL19995684 0.76 CHRM2 (0.67) ACHE
Adipic Acid SCHEMBL16394632 0.76 CHRM2 (0.67) ACHE
Cetylpyridinium SCHEMBL29000159 0.76 ACHE (0.67) BCHEACHE

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-20160118155-A1 CONDUCTIVE PASTE, METHOD OF PRODUCING CONDUCTIVE PATTERN, AND TOUCH PANEL TORAY INDUSTRIES, INC. (JP) 2016-04-28 US disclosed