SCHEMBL7057023

SCHEMBL7057023

C=C(C)C(=O)OC[CH]CO

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
THRB P10828 1/20 0.44
ALDH1A1 P00352 2/20 0.41
GLO1 Q04760 1/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL9615554 0.89 TSHR (0.52) TSHRTHRBALDH1A1GLO1POLB
SCHEMBL11412289 0.83 TSHR (0.48) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL15007610 0.83 TSHR (0.47) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL2038378 0.83 THRB (0.48) TSHRTHRBALDH1A1GLO1POLB
SCHEMBL472711 0.81 TSHR (0.45) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL10701490 0.80 TSHR (0.46) TSHRTHRBALDH1A1POLBAPEX1
SCHEMBL5654625 0.79 TSHR (0.52) TSHRTHRBALDH1A1GLO1POLB
SCHEMBL1636583 0.79 TSHR (0.52) TSHRTHRBALDH1A1GLO1POLB
SCHEMBL1636584 0.79 TSHR (0.52) TSHRTHRBALDH1A1GLO1POLB
SCHEMBL19350263 0.79 TSHR (0.48) TSHRTHRBALDH1A1GLO1POLB

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-1305297-A1 BENZOTRIAZOLES CONTAINING ALPHA-CUMYL GROUPS SUBSTITUTED BY HETEROATOMS AND COMPOSITIONS STABILIZED THEREWITH Ciba SC Holding AG (CH) 2003-05-02 EP disclosed
US-6392056-B1 FOR THERMOPLASTIC RESINS CIBA SPECIALTY CHEMICAL CORPORATION 2002-05-21 US disclosed
WO-2002012205-A1 BENZOTRIAZOLES CONTAINING α-CUMYL GROUPS SUBSTITUTED BY HETEROATOMS AND COMPOSITIONS STABILIZED THEREWITH CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-02-14 WO disclosed