SCHEMBL9360737

SCHEMBL9360737

CCOC(=O)c1ccccc1C(=O)c1ccc(CC)c(CC)c1CC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.62
CDC25B P30305 2/20 0.57
ALDH1A1 P00352 6/20 0.50
HSD17B10 Q99714 3/20 0.50
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP3A4 P08684 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
MAPT P10636 1/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
MAPK10 P53779 1/20 0.44
KMT2A Q03164 1/20 0.44
PTK2B Q14289 1/20 0.44
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
TP53 P04637 1/20 0.43

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
SCHEMBL28559559 0.89 TSHR (0.58) TSHRCDC25BALDH1A1HSD17B10TDP1
Diethyl Phthalate SCHEMBL30147367 0.84 TSHR (0.60) TSHRCDC25BALDH1A1HSD17B10TDP1
Diethyl Phthalate SCHEMBL8873370 0.84 TSHR (0.60) TSHRCDC25BALDH1A1HSD17B10TDP1
SCHEMBL9379355 0.84 TSHR (0.88) TSHRCDC25BALDH1A1HSD17B10TDP1
SCHEMBL31009568 0.84 TSHR (0.88) TSHRCDC25BALDH1A1HSD17B10TDP1
SCHEMBL4463531 0.83 TSHR (0.72) TSHRCDC25BALDH1A1HSD17B10TDP1
SCHEMBL14958374 0.79 TSHR (0.66) TSHRCDC25BALDH1A1HSD17B10TDP1
Diethyl Phthalate SCHEMBL22296 0.79 TSHR (1.00) TSHRCDC25BALDH1A1HSD17B10TDP1
Diethyl Phthalate SCHEMBL29404255 0.79 TSHR (1.00) TSHRCDC25BALDH1A1HSD17B10TDP1
Diethyl Phthalate SCHEMBL5306972 0.79 TSHR (1.00) TSHRCDC25BALDH1A1HSD17B10TDP1

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-0407808-B1 Catalyst, process for preparation of same, and process for polymerization of olefins using same SHOWA DENKO KK (JP) 1994-12-07 EP disclosed
US-5208302-A Coordination Catalysts Containing a Ketoester, Stereoregular SHOWA DENKO K.K. (JP) 1993-05-04 US disclosed
US-5049533-A Titanium, magnesium, halogen, keto-ester 7 SHOWA DENKO K.K. (JP) 1991-09-17 US disclosed
EP-0407808-A2 Catalyst, process for preparation of same, and process for polymerization of olefins using same SHOWA DENKO KABUSHIKI KAISHA (JP) 1991-01-16 EP disclosed