SCHEMBL8711526

SCHEMBL8711526

CCCCCCCCCC(N)C1(CC)CCCCC1CC

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
OPRM1 P35372 1/20 0.32
SPHK1 Q9NYA1 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
SCHEMBL8855129 1.00 SLC6A4 (0.38) SLC6A4SLC6A3OPRM1SPHK1
Hydrochloric Acid SCHEMBL9516757 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1
Water SCHEMBL9249877 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1
Hydrochloric Acid SCHEMBL8705745 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1
Water SCHEMBL9249099 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1
Water SCHEMBL9248189 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1
Hydrochloric Acid SCHEMBL9518731 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1
Hydrochloric Acid SCHEMBL9516633 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1
Hydrochloric Acid SCHEMBL9516649 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1
Water SCHEMBL9246806 0.99 SLC6A4 (0.37) SLC6A4SLC6A3OPRM1SPHK1

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
EP-0374258-B1 HIGH REFRACTIVE INDEX LENS AND METHOD FOR ITS PRODUCTION MITSUI CHEMICALS INC (JP) 1998-08-12 EP claimed