SCHEMBL12677756

SCHEMBL12677756

CC(C)C(C)(C)C(=O)OCC1CO1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
TP53 P04637 2/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
MGLL Q99685 2/20 0.35
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 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
SCHEMBL9952319 0.86 ALDH1A1 (0.45) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL9952415 0.86 ALDH1A1 (0.51) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL22236424 0.83 ALDH1A1 (0.45) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL27901852 0.82 ALDH1A1 (0.41) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL2029942 0.81 ALDH1A1 (0.53) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL25514831 0.80 ALDH1A1 (0.42) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL5519006 0.80 CA2 (0.46) ALDH1A1
SCHEMBL11359149 0.80 ALDH1A1 (0.40) ALDH1A1TP53CYP3A4MGLL
SCHEMBL19652266 0.79 ALDH1A1 (0.52) ALDH1A1TP53CYP3A4TSHRMAPK1
SCHEMBL2390572 0.79 ALDH1A1 (0.52) ALDH1A1TP53CYP3A4TSHRMAPK1

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-8273463-B2 Multilayer film for plating, method of manufacturing metal film-coated material and metal film-coated material FUJIFILM CORPORATION (JP) 2012-09-25 US disclosed
US-20090269599-A1 MULTILAYER FILM FOR PLATING, METHOD OF MANUFACTURING METAL FILM-COATED MATERIAL AND METAL FILM-COATED MATERIAL FUJIFILM CORPORATION (JP) 2009-10-29 US disclosed