SCHEMBL6790778

SCHEMBL6790778

FCN(c1ccccc1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.32
NR1I2 O75469 1/20 0.32
NR1H3 Q13133 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 1/20 0.30
RORC P51449 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 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
SCHEMBL5716560 0.85 NR1H3 (0.33) NR1H2NR1H3ALDH1A1TSHR
SCHEMBL6791746 0.85 TSHR (0.40) NR1H2NR1I2NR1H3RORCALDH1A1
SCHEMBL6789899 0.82 TP53 (0.34) NR1H2NR1I2NR1H3RORCALDH1A1
SCHEMBL31201131 0.80 RORC (0.36) NR1H2NR1I2NR1H3RORC
SCHEMBL6791407 0.79 NR1H2 (0.41) NR1H2NR1I2NR1H3
SCHEMBL6792995 0.75 MEN1 (0.37) NR1H2NR1H3CA1CA2ALDH1A1
SCHEMBL6792536 0.69 TSHR (0.44) NR1H2NR1I2NR1H3RORCALDH1A1
SCHEMBL6788308 0.69
SCHEMBL6792651 0.69 CES2 (0.32)
SCHEMBL29536653 0.69

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