SCHEMBL5716005

SCHEMBL5716005

CCCCNCCCC.Fc1ccc(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
TSHR P16473 3/20 0.37
KMT2A Q03164 2/20 0.35
HDAC3 O15379 2/20 0.35
HDAC1 Q13547 2/20 0.35
HDAC2 Q92769 2/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
ALDH1A1 P00352 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
MPO P05164 2/20 0.34
MEN1 O00255 1/20 0.34
HRH4 Q9H3N8 2/20 0.33
HRH3 Q9Y5N1 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.33
CTSL P07711 1/20 0.32
CTSS P25774 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
SCHEMBL5716452 0.97 EPHX2 (0.37) EPHX2TSHRKMT2AHDAC3HDAC1
SCHEMBL5716446 0.95 EPHX2 (0.45) EPHX2TSHRKMT2AALDH1A1SIGMAR1
SCHEMBL5716271 0.94 TSHR (0.44) EPHX2TSHRKMT2AHDAC3HDAC1
SCHEMBL5716247 0.94 EPHX2 (0.46) EPHX2TSHRKMT2AALDH1A1SIGMAR1
SCHEMBL5715671 0.91 EPHX2 (0.44) EPHX2TSHRKMT2AALDH1A1SIGMAR1
SCHEMBL5715753 0.86 EPHX2 (0.43) EPHX2TSHRKMT2AALDH1A1SIGMAR1
SCHEMBL5715971 0.85 EPHX2 (0.32) EPHX2
SCHEMBL6439619 0.84 EPHX2 (0.36) EPHX2TSHRKMT2AALDH1A1SIGMAR1
SCHEMBL5715863 0.83 EPHX2 (0.33) EPHX2CTSLCTSSCTSK
SCHEMBL5715944 0.83 EPHX2 (0.38) EPHX2TSHRKMT2AALDH1A1SIGMAR1

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