SCHEMBL1002145

SCHEMBL1002145

CCC(=O)OCC(CO)CO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NAAA Q02083 1/20 0.40
KDM4E B2RXH2 1/20 0.40
DUSP3 P51452 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
PRKCA P17252 4/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCD Q05655 1/20 0.38
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
BLM P54132 1/20 0.36
WRN Q14191 1/20 0.36

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
SCHEMBL2254863 0.91 TSHR (0.47) CYP3A4TSHRATMTDP1NAAA
SCHEMBL3628331 0.83 TSHR (0.52) CYP3A4TSHRATMTDP1NAAA
SCHEMBL14191352 0.83 TSHR (0.52) CYP3A4TSHRATMTDP1NAAA
SCHEMBL23049568 0.82 PRKCA (0.51) CYP3A4TSHRATMTDP1NAAA
SCHEMBL3503949 0.82 CYP3A4 (0.41) CYP3A4TSHRATMTDP1NAAA
SCHEMBL1408649 0.79 KDM4E (0.61) NAAAKDM4EDUSP3MEN1KMT2A
SCHEMBL9756806 0.79 PRKCA (0.39) TSHRNAAAKDM4EDUSP3MEN1
SCHEMBL374426 0.79 LMNA (0.39) NAAAKDM4EDUSP3MEN1KMT2A
SCHEMBL23049638 0.79 ALDH1A1 (0.44) CYP3A4TSHRATMTDP1NAAA
SCHEMBL12572610 0.79 KDM4E (0.61) NAAAKDM4EDUSP3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102171223-B Sulfur-containing silanes, filled elastomer compositions containing same, and articles made therefrom MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2016-04-20 CN disclosed
EP-2310397-B1 SULFUR-CONTAINING SILANE, FILLED ELASTOMERIC COMPOSITIONS CONTAINING SAME AND ARTICLES MADE THEREFROM MOMENTIVE PERFORMANCE MAT INC (US) 2012-12-12 EP disclosed
CN-102171223-A Sulfur-containing silanes, filled elastomer compositions containing same, and articles made therefrom MOMENTIVE PERFORMANCE MAT INC 2011-08-31 CN disclosed
EP-2310397-A1 SULFUR-CONTAINING SILANE, FILLED ELASTOMERIC COMPOSITIONS CONTAINING SAME AND ARTICLES MADE THEREFROM Momentive Performance Materials Inc. (US) 2011-04-20 EP disclosed
US-20110021692-A1 Sulfur-Containing Silane, Filled Elastomeric Compositions Containing Same And Articles Made Therefrom MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2011-01-27 US disclosed
US-7786200-B2 Sulfur-containing silane, filled elastomeric compositions containing same and articles made therefrom MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2010-08-31 US disclosed
US-20100029817-A1 Sulfur-containing silane, filled elastomeric compositions containing same and articles made therefrom MOMENTIVE PERFORMANCE MATERIALS INC. 2010-02-04 US disclosed
WO-2010014238-A1 SULFUR-CONTAINING SILANE, FILLED ELASTOMERIC COMPOSITIONS CONTAINING SAME AND ARTICLES MADE THEREFROM MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2010-02-04 WO disclosed