SCHEMBL8723924

SCHEMBL8723924

C=C(OCC(C)C)OCC(C)C

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.54
ALDH1A1 P00352 3/20 0.38
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL891686 0.79
SCHEMBL14898576 0.78 TSHR (0.38) TSHR
SCHEMBL8386082 0.77
SCHEMBL18973793 0.77
SCHEMBL891740 0.75
SCHEMBL8603772 0.73
SCHEMBL19325316 0.73 TSHR (0.46) TSHRALDH1A1
SCHEMBL5333698 0.73 TSHR (0.46) TSHRALDH1A1
SCHEMBL20262429 0.73 TSHR (0.71) TSHRALDH1A1HPGDSMN1; SMN2
SCHEMBL19325318 0.73

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-0609058-B1 Hexahydronaphthalene ester derivatives, their preparation and their therapeutic uses SANKYO CO (JP) 1998-12-09 EP disclosed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed
EP-0609058-A2 Hexahydronaphthalene ester derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1994-08-03 EP disclosed