SCHEMBL5680588

SCHEMBL5680588

C=C(C)C(=O)OC(C)(C)C.C=C(C)C(=O)OCCO

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.47
TSHR P16473 4/20 0.46
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 2/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
ACHE P22303 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
Tert-Butanol SCHEMBL27512753 0.86 THRB (0.52) THRBTSHRALDH1A1TDP1POLB
SCHEMBL6864388 0.86 THRB (0.59) THRBTSHRALDH1A1TDP1POLB
SCHEMBL14886 0.86
SCHEMBL29229747 0.86 THRB (0.59) THRBTSHRALDH1A1TDP1POLB
Trichloroethane SCHEMBL28690042 0.85 THRB (0.50) THRBTSHRALDH1A1TDP1POLB
SCHEMBL19747268 0.84
Ethylene SCHEMBL1248384 0.84 THRB (0.57) THRBTSHRALDH1A1TDP1POLB
SCHEMBL8743335 0.84 THRB (0.57) THRBTSHRALDH1A1TDP1POLB
Ethylene SCHEMBL10530398 0.84 THRB (0.57) THRBTSHRALDH1A1TDP1POLB
SCHEMBL20701421 0.84 THRB (0.57) THRBTSHRALDH1A1TDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060035033-A1 Spray coating method, spray coating device and inkjet recording sheet KONICA MINOLTA PHOTO IMAGING, INC. 2006-02-16 US disclosed
EP-1625893-A1 Spray coating method, spray coating device and inkjet recording sheet Konica Minolta Photo Imaging, Inc. (JP) 2006-02-15 EP disclosed
WO-2005000980-A2 PAINT FORMULATION FOR A LOW SURFACE ENERGY SUBSTRATE DOW GLOBAL TECHNOLOGIES INC. (US) 2005-01-06 WO disclosed
US-20040259990-A1 Paint formulation for a low surface energy substrate SONNENSCHEIN MARK F (US) 2004-12-23 US disclosed