SCHEMBL571409

SCHEMBL571409

O=C(OCCC(OC(=O)c1ccccc1)c1ccc2ccccc2c1)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 2/20 0.49
TDP1 Q9NUW8 3/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.44
PPARG P37231 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HRH3 Q9Y5N1 2/20 0.41
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
DRD3 P35462 1/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A3 Q01959 2/20 0.39
MAPK1 P28482 2/20 0.39
HIF1A Q16665 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL570390 0.85 MEN1 (0.51) UTS2RTDP1KMT2AMEN1MAPT
SCHEMBL1082047 0.84 TDP1 (0.56) UTS2RTDP1KMT2ALMNAALDH1A1
SCHEMBL1786364 0.84 TDP1 (0.56) UTS2RTDP1KMT2ALMNAALDH1A1
SCHEMBL1080913 0.84 TDP1 (0.56) UTS2RTDP1KMT2ALMNAALDH1A1
Ethylene Glycol SCHEMBL11963222 0.81 TDP1 (0.51) UTS2RTDP1KMT2ALMNAALDH1A1
SCHEMBL14955474 0.79 UTS2R (0.46) UTS2RTDP1KMT2AMEN1MAPT
SCHEMBL569280 0.77 TDP1 (0.44) TDP1KMT2AMEN1MAPTLMNA
SCHEMBL11253773 0.77 CYP19A1 (0.48) UTS2RALDH1A1MAPK1
SCHEMBL1791533 0.76 KMT2A (0.43) UTS2RTDP1KMT2AMEN1MAPT
SCHEMBL16048050 0.74 MAPT (0.39) UTS2RTDP1KMT2AMEN1MAPT

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-2601224-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2018-09-19 EP disclosed
EP-2601224-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2013-06-12 EP disclosed
US-20130131290-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia, s.r.l. (IT) 2013-05-23 US disclosed
WO-2012017040-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2012-02-09 WO disclosed