SCHEMBL5716196

SCHEMBL5716196

CCCN(c1cc(F)ccc1F)C(F)(F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.34
PSEN2 P49810 3/20 0.34
APH1B Q8WW43 3/20 0.34
NCSTN Q92542 3/20 0.34
APH1A Q96BI3 3/20 0.34
PSENEN Q9NZ42 3/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
RIPK1 Q13546 1/20 0.33
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
HTR2A P28223 2/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL5716462 0.91 SOAT1 (0.35) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6798740 0.87 PSEN1 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6798566 0.84 PSEN1 (0.30) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5715917 0.83 CES2 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6790311 0.81 SLC6A2 (0.36) SLC6A2SLC6A4RIPK1
SCHEMBL6787475 0.79 SOAT1 (0.38) SLC6A2SLC6A4
SCHEMBL5716146 0.78 SOAT1 (0.33) SLC6A2SLC6A4
SCHEMBL5715735 0.75 PSEN1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL6798569 0.73 PSEN1 (0.33) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL13153299 0.73 RIPK1 (0.39) PSEN1PSEN2APH1BNCSTNAPH1A

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