SCHEMBL6787484

SCHEMBL6787484

CCCCCCN(c1ccccc1)C(F)(F)C(F)(F)F.Fc1ccc(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.Fc1ccc(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.Fc1ccc(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.Fc1ccc(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F.O=[Al]O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
JAK2 O60674 1/20 0.34
RAB9A P51151 1/20 0.34
PAX8 Q06710 1/20 0.34
EPHX2 P34913 1/20 0.31
ICMT O60725 1/20 0.30
ALB P02768 1/20 0.30
TACR1 P25103 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
SCHEMBL5715726 0.78 NPC1 (0.44) NPC1JAK2RAB9APAX8ICMT
SCHEMBL5715943 0.78 NPC1 (0.44) NPC1JAK2RAB9APAX8ICMT
SCHEMBL6791674 0.77 NPC1 (0.34) NPC1JAK2RAB9APAX8ICMT
SCHEMBL6793642 0.72 NR1H2 (0.43) NPC1JAK2RAB9APAX8
SCHEMBL6792131 0.68 HDAC3 (0.33)
SCHEMBL6791085 0.67 NR1H2 (0.34) EPHX2ICMT
SCHEMBL6789626 0.67 NPC1 (0.46) NPC1JAK2RAB9APAX8ICMT
SCHEMBL27533268 0.67 NPC1 (0.46) NPC1JAK2RAB9APAX8ICMT
SCHEMBL5716192 0.67 EPHX2 (0.40) EPHX2
SCHEMBL7612249 0.67 ESR1 (0.38) NPC1JAK2RAB9APAX8ICMT

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
US-6822057-B2 OLEFIN POLYMERIZATION CATALYST SYSTEM IS A REACTION PRODUCT OF A METALLOCENES AND A COCATALYST CONTAINING FLUOROARYL SUBSTITUTED SECONDARY AMINE OR PHSOPHINE COMPOUND AND AN ANION CONTAINING GROUP 13 ELEMENT WHICH IS NONCOORDINATIG EXXON MOBIL CHEMICAL PATENTS INC. 2004-11-23 US disclosed
US-6489480-B2 COORDINATION POLYMERIZATION CATALYST FOR ALPHA-OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2002-12-03 US disclosed
US-20020115806-A1 Olefin polymerization catalysts derived from Group-15 cationic compounds and processes using them EXXONMOBIL CHEMICAL PATENTS INC. 2002-08-22 US disclosed
US-20020111265-A1 GROUP-15 CATIONIC COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYSTS EXXONMOBIL CHEMICAL PATENTS INC. 2002-08-15 US disclosed