SCHEMBL6786715

SCHEMBL6786715

CCCCP(CF)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
LTA4H P09960 2/20 0.34
PCSK9 Q8NBP7 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
PTGS2 P35354 1/20 0.33
CYP3A4 P08684 1/20 0.33
PGR P06401 1/20 0.33
RORA P35398 1/20 0.33
RORC P51449 1/20 0.33
RORB Q92753 1/20 0.33
ESR1 P03372 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
KDM4E B2RXH2 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
SCHEMBL6791425 0.92 DNM1 (0.37) LTA4HSMN1; SMN2SIGMAR1CES2CES1
SCHEMBL49367 0.89 TSHR (0.38) TSHRLTA4HPCSK9TDP1PTGS2
SCHEMBL7788089 0.87 TSHR (0.37) TSHRLTA4HPCSK9TDP1PTGS2
SCHEMBL7944468 0.87 TSHR (0.37) TSHRLTA4HPCSK9TDP1PTGS2
SCHEMBL15658774 0.85 TSHR (0.36) TSHRLTA4HPCSK9TDP1PTGS2
SCHEMBL11474282 0.85 CES2 (0.37) TSHRLTA4HPCSK9TDP1PTGS2
Iodide SCHEMBL11684155 0.83 TSHR (0.35) TSHRLTA4HPCSK9TDP1PTGS2
SCHEMBL6791527 0.83 DNM1 (0.39) LTA4HSMN1; SMN2SIGMAR1CES2CES1
SCHEMBL2550792 0.83 LTA4H (0.38) TSHRLTA4HPCSK9TDP1CYP3A4
SCHEMBL7788033 0.82 TSHR (0.34) TSHRLTA4HPCSK9TDP1PTGS2

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