SCHEMBL20168873

SCHEMBL20168873

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 6/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 2/20 0.40
HSD17B10 Q99714 2/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
TP53 P04637 1/20 0.38
PRSS1 P07477 1/20 0.38
CTSG P08311 1/20 0.38
CTRB1 P17538 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
SCHEMBL21522835 0.92 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1
SCHEMBL28492880 0.91 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1
SCHEMBL20166020 0.87 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1
SCHEMBL21522882 0.83 MAPT (0.44) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1
SCHEMBL28482597 0.83 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1CTDSP1MEN1KMT2A
SCHEMBL20165461 0.80 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1
SCHEMBL21522949 0.79 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1
SCHEMBL27341985 0.79 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1
SCHEMBL20165519 0.79 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1
SCHEMBL20165410 0.77 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1CTDSP1TSHRMEN1

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