SCHEMBL21522945

SCHEMBL21522945

CCCCN(C(=O)Oc1ccccc1)C(C)CC(=O)OCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
LMNA P02545 2/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 3/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 2/20 0.38
ALOX5 P09917 1/20 0.37
LTA4H P09960 3/20 0.37
ACHE P22303 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL28485852 0.87 ATM (0.43) L3MBTL1LMNATDP1ATMMAPT
SCHEMBL21522836 0.84 ALDH1A1 (0.48) ALDH1A1L3MBTL1LMNAPOLBHSD17B10
SCHEMBL20168886 0.81 ALDH1A1 (0.37) ALDH1A1L3MBTL1LMNAPOLBHSD17B10
SCHEMBL20165469 0.81 BCHE (0.47) ALDH1A1L3MBTL1TSHRTDP1ATM
SCHEMBL20165457 0.79 GAA (0.37) ALDH1A1POLBHSD17B10TSHRTDP1
SCHEMBL20165345 0.78 ALDH1A1 (0.37) ALDH1A1L3MBTL1LMNAPOLBHSD17B10
SCHEMBL20166109 0.78 LMNA (0.39) ALDH1A1LMNAHSD17B10TSHRTDP1
SCHEMBL21522838 0.77 MAPT (0.33) ALDH1A1L3MBTL1LMNAPOLBHSD17B10
SCHEMBL20165352 0.76 CTSK (0.34)
SCHEMBL21522901 0.75 DNM1 (0.36) ALDH1A1L3MBTL1LMNAPOLBHSD17B10

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 4 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
CN-109890852-A Catalyst components for the polymerization of olefins 巴塞尔聚烯烃意大利有限公司 2019-06-14 CN disclosed