SCHEMBL8779741

SCHEMBL8779741

CC(OC(C)C1CCC(O)CC1)C1CCC(O)CC1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.48
TSHR P16473 1/20 0.33

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
SCHEMBL8168179 0.85
SCHEMBL9616664 0.81 SHBG (0.46) SHBGTSHR
SCHEMBL149053 0.77 SHBG (0.52) SHBGTSHR
SCHEMBL766799 0.77 SHBG (0.52) SHBGTSHR
SCHEMBL42884 0.77 SHBG (0.52) SHBGTSHR
SCHEMBL6757968 0.77 SHBG (0.52) SHBGTSHR
SCHEMBL4979151 0.76
SCHEMBL18643589 0.75 SHBG (0.52) SHBG
SCHEMBL471501 0.74 SHBG (0.50) SHBGTSHR
SCHEMBL3155408 0.74 SHBG (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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0656336-B1 Process for the production of hydroxy compounds by hydrogenation of oxygenates EASTMAN CHEM CO (US) 1997-08-20 EP disclosed
EP-0656336-A1 Process for the production of hydroxy compounds by hydrogenation of oxygenates EASTMAN CHEMICAL COMPANY (US) 1995-06-07 EP disclosed
US-5395990-A Hydrogenation of esters and aldehydes using copper and/or Group VIII metal catalyst; by-product inhibition; hydroxylation EASTMAN CHEMICAL COMPANY (US) 1995-03-07 US disclosed