SCHEMBL16038441

SCHEMBL16038441

CCCCCCCCCCCCCCCCC(C)(COC)COC

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
SPHK2 Q9NRA0 2/20 0.37
SPHK1 Q9NYA1 1/20 0.37
GGPS1 O95749 6/20 0.35
SMPD1 P17405 3/20 0.35
FDPS P14324 9/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CES2 O00748 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR3 Q9UBY5 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
SCHEMBL4666440 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL4663085 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL4663133 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL16038174 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL16036952 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL16037164 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL16037420 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL4664635 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL16038019 1.00 TSHR (0.38) TSHRTHRBSPHK2SPHK1GGPS1
SCHEMBL4662873 0.98 LMNA (0.34) TSHRTHRBSPHK2SPHK1GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284392-B2 Mixed internal donor structures for 1-olefin polymerization catalysts BASF CORPORATION (US) 2016-03-15 US claimed
US-20140275452-A1 MIXED INTERNAL DONOR STRUCTURES FOR 1-OLEFIN POLYMERIZATION CATALYSTS BASF CATALYSTS LLC (US) 2014-09-18 US claimed
CN-110023351-B Main catalyst composition prepared by combining internal electron donors 格雷斯公司 2022-04-26 CN disclosed
US-11014995-B2 Procatalyst composition made with a combination of internal electron donors W.R. Grace & Co.—Conn. (US) 2021-05-25 US disclosed
EP-3523343-A1 PROCATALYST COMPOSITION MADE WITH A COMBINATION OF INTERNAL ELECTRON DONORS W.R. Grace & Co.-Conn. (US) 2019-08-14 EP disclosed
US-20190211118-A1 PROCATALYST COMPOSITION MADE WITH A COMBINATION OF INTERNAL ELECTRON DONORS W. R. GRACE & CO.-CONN. 2019-07-11 US disclosed
WO-2018067367-A1 PROCATALYST COMPOSITION MADE WITH A COMBINATION OF INTERNAL ELECTRON DONORS W.R. GRACE & CO.-CONN. (US) 2018-04-12 WO disclosed
US-9284392-B2 Mixed internal donor structures for 1-olefin polymerization catalysts BASF CORPORATION (US) 2016-03-15 US disclosed
US-20140275452-A1 MIXED INTERNAL DONOR STRUCTURES FOR 1-OLEFIN POLYMERIZATION CATALYSTS BASF CATALYSTS LLC (US) 2014-09-18 US disclosed