SCHEMBL5715895

SCHEMBL5715895

CCCCN(CC(C)CCC(CC)CCC)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 5/20 0.35
ADRB2 P07550 1/20 0.35
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
NPSR1 Q6W5P4 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPT P10636 2/20 0.33
GFER P55789 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
KDM4E B2RXH2 2/20 0.33
ESR1 P03372 1/20 0.32
TSHR P16473 1/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
HPGD P15428 1/20 0.32
AR P10275 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
SCHEMBL5715673 0.95 NPC1 (0.37) CNR2ALDH1A1ADRB2KDM4ETACR1
SCHEMBL6439566 0.95 NPC1 (0.37) CNR2ALDH1A1ADRB2KDM4ETACR1
SCHEMBL5716599 0.88 CNR2 (0.40) CNR2ALDH1A1ADRB2NR1H2NR1H3
SCHEMBL5716254 0.86 ALDH1A1 (0.38) CNR2ALDH1A1ADRB2TDP1MAPT
SCHEMBL6799231 0.84 TSHR (0.33) TSHR
SCHEMBL8438809 0.81 ALDH1A1 (0.46) CNR2ALDH1A1ADRB2NR1H2NR1H3
SCHEMBL5715745 0.78 NR1H2 (0.31) NR1H2NR1H3LMNA
SCHEMBL5715841 0.76
SCHEMBL11904607 0.75 ALDH1A1 (0.43) CNR2ALDH1A1MAPTLMNAKDM4E
SCHEMBL8440732 0.75 ALDH1A1 (0.46) CNR2ALDH1A1ADRB2TDP1MAPT

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-1661900-A1 Olefin polymerization cocatalysts derived from group-15 cationic compounds and processes using them ExxonMobil Chemical Patents Inc. (US) 2006-05-31 EP disclosed
EP-1252166-B1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM EXXONMOBIL CHEM PATENTS INC (US) 2005-11-09 EP disclosed