SCHEMBL15969857

SCHEMBL15969857

CCOC(=O)CC(CC(C)C)c1ccccc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.50
HTT P42858 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
PLIN1 O60240 1/20 0.42
LMNA P02545 1/20 0.42
PLIN5 Q00G26 1/20 0.42
KMT2A Q03164 1/20 0.42
ABHD5 Q8WTS1 1/20 0.42
NLRP3 Q96P20 2/20 0.41
TSHR P16473 2/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.40
ANPEP P15144 1/20 0.40
F2 P00734 1/20 0.39
GLA P06280 1/20 0.39
DHFR P00374 1/20 0.38

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
SCHEMBL18151306 0.84 POLB (0.58) POLBHTTNPSR1L3MBTL1MAPT
SCHEMBL28362379 0.83 TSHR (0.54) NPSR1MAPTLMNANLRP3TSHR
SCHEMBL15968923 0.82 POLB (0.48) POLBHTTNPSR1L3MBTL1MAPT
SCHEMBL15969801 0.82 POLB (0.49) POLBHTTNPSR1L3MBTL1MAPT
SCHEMBL312971 0.80 POLB (0.48) POLBHTTNPSR1L3MBTL1MAPT
SCHEMBL15253446 0.80 F2 (0.53) NPSR1MEN1LMNAKMT2ATSHR
SCHEMBL15970306 0.79 POLB (0.44) POLBHTTNPSR1L3MBTL1MAPT
SCHEMBL14874588 0.76 KMT2A (0.43) POLBHTTNPSR1L3MBTL1MAPT
SCHEMBL14874322 0.76 KMT2A (0.43) POLBHTTNPSR1L3MBTL1MAPT
SCHEMBL18151122 0.76 HTT (0.66) POLBHTTNPSR1L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2768873-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2017-11-22 EP disclosed
US-8921253-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2014-12-30 US disclosed
US-20140243490-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia, s.r.l. (IT) 2014-08-28 US disclosed