SCHEMBL5715802

SCHEMBL5715802

CCCCCCCCCNC(F)(F)C(F)(F)F.Fc1c(F)c(F)c(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.37
EPHX2 P34913 2/20 0.33
MLYCD O95822 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
ADH1B P00325 1/20 0.31
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
ADH4 P08319 1/20 0.31
ADH7 P40394 1/20 0.31

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
SCHEMBL5715557 0.93 TLR8 (0.30)
SCHEMBL28725236 0.87 EPHX1 (0.45) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL28581070 0.87 EPHX1 (0.45) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL5716403 0.86 EPHX2 (0.30) EPHX2
SCHEMBL5716192 0.83 EPHX2 (0.40) EPHX2MLYCD
SCHEMBL5715987 0.79
SCHEMBL5716279 0.77 TSHR (0.59) EPHX1ALDH1A1TSHRADH1BADH1C
SCHEMBL5716118 0.77 TSHR (0.59) EPHX1ALDH1A1TSHRADH1BADH1C
Biphenyl SCHEMBL5715621 0.76 NAAA (0.41) EPHX1ALDH1A1
SCHEMBL5715756 0.75 TSHR (0.56) EPHX1ALDH1A1TSHRADH1BADH1C

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
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
EP-1252166-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2002-10-30 EP disclosed
WO-2001042249-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2001-06-14 WO disclosed