SCHEMBL20165521

SCHEMBL20165521

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
KMT2A Q03164 2/20 0.39
HPGD P15428 1/20 0.39
LMNA P02545 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32
SOAT1 P35610 1/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL27959950 0.82 SOAT1 (0.33) ALDH1A1LMNAHSD17B10SOAT1
SCHEMBL19822000 0.77 KDM6B (0.37) ALDH1A1HSD17B10CHRNB2CHRNA4
SCHEMBL3810536 0.75 KDM6B (0.35) CHRNB2CHRNA4
SCHEMBL2230421 0.75 ALDH1A1 (0.50) ALDH1A1KMT2AHPGDLMNAHSD17B10
SCHEMBL10936503 0.75 ALDH1A1 (0.52) ALDH1A1KMT2AHPGDLMNAHSD17B10
SCHEMBL280605 0.74
SCHEMBL31352637 0.74 ALDH1A1 (0.48) ALDH1A1KMT2AHPGDLMNAHSD17B10
SCHEMBL8954889 0.74
SCHEMBL118486 0.74
SCHEMBL28212346 0.72 ALDH1A1 (0.46) ALDH1A1KMT2AHPGDLMNAHSD17B10

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
EP-3541857-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2019-09-25 EP disclosed
WO-2018091375-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-05-24 WO disclosed