SCHEMBL2322012

SCHEMBL2322012

CCOC(=O)C(CC)(CC)C(=O)CC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TSHR P16473 1/20 0.42
SOAT1 P35610 1/20 0.42
ALDH1A1 P00352 4/20 0.41
LMNA P02545 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
CYP4F2 P78329 2/20 0.41
CYP4A11 Q02928 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSD17B10 Q99714 1/20 0.39
PKM P14618 3/20 0.38
KDM4E B2RXH2 1/20 0.38
THRB P10828 1/20 0.37
ALOX15 P16050 1/20 0.37
MGAM O43451 1/20 0.37

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
SCHEMBL1244565 0.85 MEN1 (0.54) MEN1KMT2ATSHRSOAT1ALDH1A1
SCHEMBL23091475 0.83 MEN1 (0.52) MEN1KMT2ATSHRSOAT1ALDH1A1
Ammonia Solution, Strong SCHEMBL29049233 0.83 MEN1 (0.52) MEN1KMT2ATSHRSOAT1ALDH1A1
Iodide SCHEMBL10533617 0.83 MEN1 (0.52) MEN1KMT2ATSHRSOAT1ALDH1A1
SCHEMBL27889245 0.83 MEN1 (0.52) MEN1KMT2ATSHRSOAT1ALDH1A1
SCHEMBL6619664 0.83 ALDH1A1 (0.46) MEN1KMT2ATSHRSOAT1ALDH1A1
SCHEMBL29177162 0.83 MEN1 (0.48) MEN1KMT2ATSHRSOAT1ALDH1A1
SCHEMBL28258333 0.83 MEN1 (0.44) MEN1KMT2ATSHRSOAT1ALDH1A1
SCHEMBL2316057 0.79 MMP8 (0.42) MEN1KMT2ATSHRSOAT1ALDH1A1
SCHEMBL29008744 0.79 MEN1 (0.48) MEN1KMT2ATSHRSOAT1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102040620-B Group 4 metal precursors for metal-containing films AIR PROD & CHEM 2014-09-03 CN disclosed
EP-1730204-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE SRL (IT) 2011-08-10 EP disclosed
US-7544748-B2 Components and catalysis for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2009-06-09 US disclosed
US-20070208150-A1 Components and Catalysis for the Polymerization of Olefins BASELL POLIOLEFINE ITALIA S.R.L (IT) 2007-09-06 US disclosed
EP-1730204-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2006-12-13 EP disclosed
WO-2005097841-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2005-10-20 WO disclosed