SCHEMBL3669888

SCHEMBL3669888

CC(N)C1(S)CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 11/20 0.36
SLC6A4 P31645 10/20 0.36
SLC6A2 P23975 6/20 0.34

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
SCHEMBL13778693 0.77
SCHEMBL185384 0.77 SLC6A3 (0.39) SLC6A3SLC6A4SLC6A2
Iodide SCHEMBL11529339 0.74
SCHEMBL2781863 0.73 SLC6A3 (0.35) SLC6A3SLC6A4SLC6A2
SCHEMBL9562471 0.73
SCHEMBL3672948 0.72 SLC6A4 (0.43) SLC6A3SLC6A4SLC6A2
SCHEMBL3668481 0.69 SLC6A4 (0.33) SLC6A3SLC6A4SLC6A2
SCHEMBL23485486 0.69 SLC6A3 (0.33) SLC6A3SLC6A4SLC6A2
SCHEMBL24469569 0.69 SLC6A3 (0.38) SLC6A3SLC6A4SLC6A2
SCHEMBL6061506 0.69 SLC6A3 (0.42) SLC6A3SLC6A4SLC6A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1426392-B1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2010-02-24 EP disclosed
US-6960640-B2 Composition for optical material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2005-11-01 US disclosed
US-20040147708-A1 Composition for optical material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-07-29 US disclosed
EP-1426392-A1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-06-09 EP disclosed