SCHEMBL5715944

SCHEMBL5715944

CCCCCCNCCC(CC)CCCC.Fc1ccc(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 5/20 0.33
TSHR P16473 2/20 0.33
CYP3A4 P08684 2/20 0.33
KDM4E B2RXH2 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
LMNA P02545 2/20 0.31
CA2 P00918 1/20 0.30
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
SCHEMBL6439619 0.99 EPHX2 (0.36) EPHX2SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL5715770 0.93 ALDH1A1 (0.35) EPHX2ALDH1A1TSHRCYP3A4KDM4E
SCHEMBL5715913 0.90 ALDH1A1 (0.35) EPHX2ALDH1A1TSHRCYP3A4KDM4E
SCHEMBL5715951 0.89 ALDH1A1 (0.34) EPHX2ALDH1A1TSHRCYP3A4KDM4E
SCHEMBL5716247 0.88 EPHX2 (0.46) EPHX2SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL5716446 0.87 EPHX2 (0.45) EPHX2SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL5715671 0.86 EPHX2 (0.44) EPHX2SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL5715757 0.83 EPHX2 (0.35) EPHX2SMN1; SMN2MEN1KMT2A
SCHEMBL5716005 0.83 EPHX2 (0.38) EPHX2SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL6460674 0.82 ALDH1A1 (0.40) ALDH1A1TSHRCYP3A4KDM4EPRSS1

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 2 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