SCHEMBL7190867

SCHEMBL7190867

CCCCC(=O)CCO[Si](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.42
CES1 P23141 3/20 0.42
KMT2A Q03164 3/20 0.40
IAPP P10997 2/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 1/20 0.40
RECQL P46063 1/20 0.40
DUT P33316 1/20 0.40
TSHR P16473 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP3A4 P08684 2/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
LMNA P02545 3/20 0.37
MAPT P10636 2/20 0.37
NR1I2 O75469 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
SCHEMBL7184125 0.90 CES2 (0.40) CES2CES1IAPPKDM4ERECQL
SCHEMBL7190570 0.89 DUT (0.46) KMT2ADUTTSHRL3MBTL1TDP1
SCHEMBL7190720 0.88 DUT (0.43) KMT2ADUTTDP1CYP3A4ALDH1A1
SCHEMBL7190329 0.88 DUT (0.43) CES2CES1IAPPKDM4ERECQL
SCHEMBL7195797 0.86 CES2 (0.44) CES2CES1KMT2AIAPPMEN1
SCHEMBL7195643 0.85 DUT (0.39) CES2CES1IAPPRECQLDUT
SCHEMBL7188133 0.83 DUT (0.43) CES2CES1IAPPRECQLDUT
SCHEMBL7185042 0.81 DUT (0.43) CES2CES1RECQLDUTTSHR
SCHEMBL7190978 0.81 CES2 (0.45) CES2CES1KMT2AMEN1TSHR
SCHEMBL705748 0.79 DUT (0.47) DUTTSHRL3MBTL1TDP1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6534665-B1 Used for polymerization and copolymerization of olefins REPSOL QUIMICA S.A. (ES) 2003-03-18 US claimed
US-6534665-B1 Used for polymerization and copolymerization of olefins REPSOL QUIMICA S.A. (ES) 2003-03-18 US disclosed