SCHEMBL379120

SCHEMBL379120

C=C(C)C(=O)OCCNO[C]=O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.46
TSHR P16473 3/20 0.44
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL15998378 0.79 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL16379004 0.78 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL163646 0.78 THRB (0.48) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL16378672 0.77 THRB (0.55) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL9321905 0.77 THRB (0.55) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL16588235 0.75 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL108325 0.75 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL13950019 0.75 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL14712313 0.75 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL3457804 0.74 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8900556-B2 Hardenable thermally responsive compositions 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-12-02 US disclosed
EP-1590000-B1 HARDENABLE THERMALLY RESPONSIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES CO (US) 2012-01-25 EP disclosed
US-20070207094-A1 HARDENABLE THERMALLY RESPONSIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY 2007-09-06 US disclosed
EP-1590000-A1 HARDENABLE THERMALLY RESPONSIVE COMPOSITIONS 3M Innovative Properties Company (US) 2005-11-02 EP disclosed
WO-2004069278-A1 HARDENABLE THERMALLY RESPONSIVE COMPOSITIONS 3M INNOVATIVE PROPERTIES COMPANY (US) 2004-08-19 WO disclosed
US-20040151691-A1 viscosity modifier (particularly an ethylene oxide-propylene oxide block polymer), polymerizable component (particularly an acrylate) ; and water; especially for use in dental compositions 3M INNOVATIVE PROPERTIES COMPANY 2004-08-05 US disclosed