SCHEMBL18249477

SCHEMBL18249477

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

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.47
TSHR P16473 1/20 0.41
PRTN3 P24158 1/20 0.38
LMNA P02545 5/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
CYP3A4 P08684 3/20 0.36
PIN1 Q13526 1/20 0.35
HSD17B10 Q99714 2/20 0.35
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HIF1A Q16665 1/20 0.35

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
SCHEMBL18249422 0.85 ELANE (0.48) ELANETSHRPRTN3LMNAMAPT
SCHEMBL20164248 0.85 PTGS2 (0.42) TSHRLMNAALDH1A1MEN1KMT2A
SCHEMBL18249478 0.83 TSHR (0.41) ELANETSHRPRTN3LMNANPSR1
SCHEMBL20164269 0.82 TSHR (0.44) ELANETSHRLMNAMAPTALDH1A1
SCHEMBL18249465 0.81 KMT2A (0.45) LMNAMAPTNPSR1ALDH1A1MEN1
SCHEMBL20164266 0.77 SMN1; SMN2 (0.41) TSHRLMNAMAPTNPSR1ALDH1A1
SCHEMBL20164247 0.77 KMT2A (0.45) ELANELMNAMAPTNPSR1ALDH1A1
SCHEMBL20164208 0.74 LMNA (0.47) ELANELMNAMAPTNPSR1ALDH1A1
SCHEMBL18249383 0.74 TSHR (0.38) ELANETSHRPRTN3LMNAMAPT
SCHEMBL997654 0.73 SIGMAR1 (0.43) TSHRLMNANPSR1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3298048-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2019-07-03 EP disclosed
US-10221256-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2019-03-05 US disclosed
US-20180142044-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 US disclosed
EP-3298048-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2018-03-28 EP disclosed
WO-2016184884-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2016-11-24 WO disclosed