SCHEMBL20165519

SCHEMBL20165519

CCCCOC(=O)CC(C)N(C(=O)OCC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
L3MBTL1 Q9Y468 4/20 0.41
TSHR P16473 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 2/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA4 P43681 1/20 0.40
ALDH1A1 P00352 6/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 2/20 0.40
NPC1 O15118 1/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP3A4 P08684 2/20 0.39
MAPK1 P28482 2/20 0.39
POLB P06746 1/20 0.39
CYP1A2 P05177 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
SCHEMBL21522915 0.92 LMNA (0.44) SMN1; SMN2L3MBTL1TSHRTDP1MEN1
SCHEMBL20165461 0.90 SMN1; SMN2 (0.48) SMN1; SMN2L3MBTL1TSHRMEN1KMT2A
SCHEMBL21522912 0.85 MAPT (0.44) SMN1; SMN2L3MBTL1TSHRMEN1KMT2A
SCHEMBL11802073 0.80 SMN1; SMN2 (0.50) SMN1; SMN2L3MBTL1TSHRMEN1KMT2A
SCHEMBL20168873 0.79 SMN1; SMN2 (0.43) SMN1; SMN2L3MBTL1TSHRTDP1MEN1
SCHEMBL21522949 0.78 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1TSHRMEN1KMT2A
SCHEMBL28138500 0.76 ALDH1A1 (0.60) SMN1; SMN2L3MBTL1MEN1KMT2AMAPT
SCHEMBL21522845 0.76 NAAA (0.40) SMN1; SMN2L3MBTL1TSHRMAPTALDH1A1
SCHEMBL21522835 0.75 SMN1; SMN2 (0.45) SMN1; SMN2L3MBTL1TSHRMEN1KMT2A
SCHEMBL20166020 0.75 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1TSHRMEN1KMT2A

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-3541857-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2020-09-09 EP disclosed
US-10654946-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2020-05-19 US disclosed
US-20190330388-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2019-10-31 US disclosed
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