SCHEMBL8840449

SCHEMBL8840449

C=CCOCc1nccc(N(OCc2ccccc2)C2(c3ccccc3)CCCCC2)c1OC

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.31
OPRL1 P41146 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SLC6A5 Q9Y345 1/20 0.30

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
SCHEMBL8840422 0.89 OPRM1 (0.34) OPRM1OPRL1SLC6A5
SCHEMBL9035779 0.87 OPRM1 (0.34) OPRM1OPRL1SLC6A5
SCHEMBL8840555 0.86 L3MBTL1 (0.34) L3MBTL1
SCHEMBL8840381 0.84 OPRM1 (0.34) OPRM1OPRL1
SCHEMBL9034632 0.83 OPRM1 (0.36) OPRM1OPRL1SLC6A5
SCHEMBL8840459 0.81 OPRM1 (0.32) OPRM1OPRL1
SCHEMBL8840413 0.80 OPRM1 (0.37) OPRM1OPRL1
SCHEMBL8840558 0.80 MAPT (0.33) OPRM1OPRL1
SCHEMBL8840404 0.80 TSHR (0.36) OPRM1OPRL1
SCHEMBL8840544 0.80 MEN1 (0.36) OPRM1OPRL1SLC6A5

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-5650417-A Substituted pyridines, their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1997-07-22 US disclosed