SCHEMBL5715955

SCHEMBL5715955

CCCCNCCC(CC)CCCC.Fc1c(F)c(F)c(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
TSHR P16473 4/20 0.44
CYP3A4 P08684 3/20 0.44
TDP1 Q9NUW8 1/20 0.37
CA2 P00918 2/20 0.35
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HRH4 Q9H3N8 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL5716273 0.93 ALDH1A1 (0.44) ALDH1A1TSHRCYP3A4TDP1CA2
SCHEMBL5716406 0.83 ALDH1A1 (0.42) ALDH1A1TSHRCYP3A4TDP1CA2
SCHEMBL5715966 0.81 ALDH1A1 (0.40) ALDH1A1TSHRCYP3A4TDP1KDM4E
SCHEMBL5716069 0.81 ALDH1A1 (0.34) ALDH1A1TSHRCYP3A4
SCHEMBL6439619 0.81 EPHX2 (0.36) ALDH1A1TSHRCYP3A4CA2KDM4E
SCHEMBL5715944 0.80 EPHX2 (0.38) ALDH1A1TSHRCYP3A4CA2KDM4E
SCHEMBL5716458 0.80 ALDH1A1 (0.31) ALDH1A1TSHRCYP3A4
SCHEMBL5716536 0.80 ALDH1A1 (0.31) ALDH1A1TSHRCYP3A4
SCHEMBL5715770 0.79 ALDH1A1 (0.35) ALDH1A1TSHRCYP3A4CA2KDM4E
SCHEMBL5715701 0.78 ALDH1A1 (0.38) ALDH1A1TSHRCYP3A4CA2KDM4E

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