SCHEMBL15899595

SCHEMBL15899595

CCCOCCc1ccc(OC(=O)Oc2ccc(CCOCCC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.50
LMNA P02545 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ALDH1A1 P00352 2/20 0.45
THRA P10827 1/20 0.44
ACACB O00763 2/20 0.43
KMT2A Q03164 4/20 0.43
PLA2G1B P04054 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43
MAPK1 P28482 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
MEN1 O00255 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
USP2 O75604 1/20 0.41
CYP3A4 P08684 1/20 0.41
CASP1 P29466 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
SLC5A1 P13866 1/20 0.40

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
SCHEMBL15899262 0.92 THRB (0.53) THRBLMNAL3MBTL1ALDH1A1THRA
SCHEMBL15899522 0.88 THRB (0.45) THRBLMNAL3MBTL1ALDH1A1THRA
SCHEMBL15899166 0.88 THRB (0.47) THRBLMNAL3MBTL1ALDH1A1THRA
SCHEMBL9259786 0.84 L3MBTL1 (0.47) THRBLMNAL3MBTL1ALDH1A1THRA
SCHEMBL234883 0.83 THRB (0.68) THRBLMNAL3MBTL1ALDH1A1THRA
SCHEMBL2536890 0.80 ACACB (0.50) THRBLMNAALDH1A1ACACBKMT2A
SCHEMBL233924 0.80 THRB (0.63) THRBALDH1A1THRA
SCHEMBL15899454 0.80 ACACB (0.44) THRBALDH1A1ACACBKMT2AMEN1
SCHEMBL17473172 0.79 THRB (0.58) THRBLMNAL3MBTL1ALDH1A1THRA
SCHEMBL17473008 0.79 THRB (0.62) THRBLMNAL3MBTL1ALDH1A1THRA

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
EP-2759552-B1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER TOHO TITANIUM CO LTD (JP) 2016-02-10 EP disclosed
US-9243081-B2 Solid catalyst component for polymerization of olefin, catalyst for polymerization of olefin, and method for producing olefin polymer TOHO TITANIUM CO., LTD. (JP) 2016-01-26 US disclosed
US-20140343237-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER TOHO TITANIUM CO., LTD. (JP) 2014-11-20 US disclosed
EP-2759552-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFIN, CATALYST FOR POLYMERIZATION OF OLEFIN, AND METHOD FOR PRODUCING OLEFIN POLYMER Toho Titanium CO., LTD. (JP) 2014-07-30 EP disclosed