SCHEMBL8645129

SCHEMBL8645129

CCOCC(O)C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.32
VDR P11473 6/20 0.32
AR P10275 4/20 0.32
KDM4E B2RXH2 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
SCHEMBL309462 0.77 CETP (0.40) TSHRHSD17B10ALDH1A1
SCHEMBL311426 0.77 CETP (0.40) TSHRHSD17B10ALDH1A1
SCHEMBL11030152 0.77 CYP2C19 (0.35) TSHRHSD17B10ALDH1A1
SCHEMBL309463 0.77 CETP (0.40) TSHRHSD17B10ALDH1A1
SCHEMBL17857648 0.77 TSHR (0.38) TSHR
SCHEMBL2997521 0.75 TSHR (0.32) TSHRMAPK1HSD17B10
SCHEMBL28310377 0.75 TSHR (0.41) TSHRMAPK1HSD17B10ALDH1A1VDR
SCHEMBL31685204 0.75 CETP (0.39) HSD17B10
SCHEMBL2202088 0.75 TSHR (0.50) TSHRMAPK1VDRAR
SCHEMBL14904896 0.73 TSHR (0.36) TSHRALDH1A1

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
EP-0563557-B1 Volatile rate earth metal alkoxides, especially for the preparation of rare earth metal oxides, and alcohols for the synthesis of volatile compounds PATENT TREUHAND GES FUER ELEKTRISCHE GLUEHLAMPEN MBH (DE) 1998-08-12 EP disclosed
EP-0563557-A2 Volatile rate earth metal alkoxides, especially for the preparation of rare earth metal oxides, and alcohols for the synthesis of volatile compounds Patent-Treuhand-Gesellschaft für elektrische Glühlampen mbH (DE) 1993-10-06 EP disclosed