SCHEMBL25754246

SCHEMBL25754246

NCCOCCOCC1CCCN1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRNA3 P32297 3/20 0.37
CHRNB4 P30926 1/20 0.37
LTA4H P09960 3/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36

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
SCHEMBL24674661 0.87 CHRNA3 (0.38) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4
SCHEMBL4470435 0.80
SCHEMBL18398793 0.80 CHRNA3 (0.46) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4
SCHEMBL18461801 0.79 CHRNA3 (0.45) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4
SCHEMBL25883074 0.79 CHRNA3 (0.44) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4
SCHEMBL10273868 0.79 CHRNA3 (0.44) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4
SCHEMBL10273859 0.79 CHRNA3 (0.44) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4
SCHEMBL30555230 0.76 CHRNA3 (0.38) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4
SCHEMBL24002768 0.76 CHRNA3 (0.40) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4
SCHEMBL12996851 0.76 SMN1; SMN2 (0.46) CHRNA3CHRNB4LTA4HCHRNB2CHRNA4

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-20230193067-A1 METAL OXIDE COMPOSITION, LIGHT-EMITTING DEVICE USING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 US disclosed