SCHEMBL18249485

SCHEMBL18249485

CCCCOC(=O)N(C)CC(CCC)OC(=O)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.47
TSHR P16473 4/20 0.45
LMNA P02545 4/20 0.42
MEN1 O00255 1/20 0.42
ALOX12 P18054 1/20 0.42
KMT2A Q03164 1/20 0.42
ESR1 P03372 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP2D6 P10635 1/20 0.42
MAPK1 P28482 1/20 0.42
NR1H2 P55055 1/20 0.42
RNASEL Q05823 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
UTS2R Q9UKP6 4/20 0.42
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 1/20 0.41
PDE4D Q08499 1/20 0.41
ALDH1A1 P00352 2/20 0.39
CHRNB2 P17787 1/20 0.39

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
SCHEMBL18249444 0.90 UTS2R (0.46) GAATSHRLMNAMEN1ALOX12
SCHEMBL18249487 0.81 TSHR (0.49) GAATSHRLMNAESR1CYP1A2
SCHEMBL15269461 0.80 TSHR (0.47) GAATSHRLMNAMEN1ALOX12
SCHEMBL18249404 0.77 CYP4F2 (0.40) TSHRKMT2AESR1SMN1; SMN2ALDH1A1
SCHEMBL18249425 0.77 UTS2R (0.45) GAATSHRLMNAMEN1ALOX12
SCHEMBL20164283 0.75 TSHR (0.50) GAATSHRLMNAMEN1ALOX12
SCHEMBL6057147 0.74 ESR1 (0.72) GAATSHRLMNAESR1CYP1A2
SCHEMBL17317098 0.73 MEN1 (0.43) TSHRLMNAMEN1ALOX12KMT2A
SCHEMBL14334912 0.73 MEN1 (0.52) GAATSHRLMNAMEN1ALOX12
SCHEMBL15269465 0.72 TSHR (0.49) GAATSHRLMNAMEN1ALOX12

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-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