SCHEMBL8167641

SCHEMBL8167641

CCCC(OC(CCC)C1CCC1)C1CCC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL3319013 0.95 SHBG (0.41) SHBG
SCHEMBL29101113 0.93 SHBG (0.44) SHBG
SCHEMBL3313678 0.93 SHBG (0.44) SHBG
SCHEMBL8162081 0.90 SHBG (0.31) SHBG
SCHEMBL8167847 0.80 SHBG (0.44) SHBG
SCHEMBL21419797 0.79 SHBG (0.40) SHBG
SCHEMBL21175623 0.77 TSHR (0.40) SHBG
SCHEMBL21175625 0.77 TSHR (0.40) SHBG
SCHEMBL11555898 0.77 TSHR (0.40) SHBG
SCHEMBL27481649 0.77 TSHR (0.40) SHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6037477-A CONTACTING AN ETHER WITH OXYGEN IN THE PRESENCE OF AN OXIDATION CATALYST TO PRODUCE ESTER OR ANHYDRIDE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-03-14 US disclosed
EP-0878458-A1 Oxidation process of ethers Daicel Chemical Industries, Ltd. (JP) 1998-11-18 EP disclosed