SCHEMBL5715840

SCHEMBL5715840

CCCCCCC(F)(F)C(F)(F)C(F)(F)N(CCC)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
PAX8 Q06710 2/20 0.38
JAK2 O60674 1/20 0.38
KCNH2 Q12809 3/20 0.35
SIGMAR1 Q99720 2/20 0.34
EBP Q15125 1/20 0.34
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
ESR1 P03372 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
TACR1 P25103 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
GPX4 P36969 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
SCHEMBL6791674 0.86 NPC1 (0.34) NPC1RAB9APAX8JAK2KMT2A
SCHEMBL5716386 0.85 ALDH1A1 (0.34) NPC1RAB9APAX8JAK2ALDH1A1
SCHEMBL5715943 0.81 NPC1 (0.44) NPC1RAB9APAX8JAK2KCNH2
SCHEMBL5715726 0.81 NPC1 (0.44) NPC1RAB9APAX8JAK2KCNH2
SCHEMBL6791407 0.80 NR1H2 (0.41) NPC1RAB9APAX8JAK2NR1H2
SCHEMBL6789899 0.80 TP53 (0.34) NR1H2NR1H3KMT2ATRPM8ESR1
SCHEMBL6793642 0.78 NR1H2 (0.43) NPC1RAB9APAX8JAK2NR1H2
SCHEMBL27533268 0.78 NPC1 (0.46) NPC1RAB9APAX8JAK2KCNH2
SCHEMBL6789626 0.78 NPC1 (0.46) NPC1RAB9APAX8JAK2KCNH2
SCHEMBL5715836 0.76

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-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
EP-1252166-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2002-10-30 EP disclosed
WO-2001042249-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2001-06-14 WO disclosed