SCHEMBL6791407

SCHEMBL6791407

CCCCN(c1ccccc1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.41
NR1H3 Q13133 3/20 0.41
MLYCD O95822 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
ESR1 P03372 1/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NPC1 O15118 1/20 0.34
JAK2 O60674 1/20 0.34
RAB9A P51151 1/20 0.34
PAX8 Q06710 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
NR1I2 O75469 1/20 0.33
CASP1 P29466 1/20 0.33
BRCA1 P38398 1/20 0.33
CASP7 P55210 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL6789899 0.93 TP53 (0.34) NR1H2NR1H3ESR1KMT2AMEN1
SCHEMBL6793642 0.88 NR1H2 (0.43) NR1H2NR1H3MLYCDTDP1ESR1
SCHEMBL6791746 0.83 TSHR (0.40) NR1H2NR1H3MLYCDSLC6A2SLC6A4
SCHEMBL5715943 0.82 NPC1 (0.44) NR1H2NR1H3NPC1JAK2RAB9A
SCHEMBL5715726 0.82 NPC1 (0.44) NR1H2NR1H3NPC1JAK2RAB9A
SCHEMBL18560078 0.81 NR1H2 (0.42) NR1H2NR1H3MLYCDTDP1ESR1
SCHEMBL5715840 0.80 NPC1 (0.38) NR1H2NR1H3TDP1ESR1KMT2A
SCHEMBL6790778 0.79 NR1H2 (0.32) NR1H2NR1H3NR1I2
SCHEMBL31201131 0.79 RORC (0.36) NR1H2NR1H3KMT2AMEN1L3MBTL1
SCHEMBL14997776 0.75 TDP1 (0.42) NR1H2NR1H3TDP1ESR1KMT2A

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