SCHEMBL6439619

SCHEMBL6439619

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

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.36
ALDH1A1 P00352 5/20 0.34
TSHR P16473 2/20 0.34
CYP3A4 P08684 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
LMNA P02545 1/20 0.31
CA2 P00918 1/20 0.31
HRH4 Q9H3N8 1/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL5715944 0.99 EPHX2 (0.38) EPHX2ALDH1A1TSHRCYP3A4SMN1; SMN2
SCHEMBL5715770 0.94 ALDH1A1 (0.35) EPHX2ALDH1A1TSHRCYP3A4KDM4E
SCHEMBL5715913 0.91 ALDH1A1 (0.35) EPHX2ALDH1A1TSHRCYP3A4KDM4E
SCHEMBL5715951 0.90 ALDH1A1 (0.34) EPHX2ALDH1A1TSHRCYP3A4KDM4E
SCHEMBL5716247 0.87 EPHX2 (0.46) EPHX2ALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL5716446 0.85 EPHX2 (0.45) EPHX2ALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL5715671 0.84 EPHX2 (0.44) EPHX2ALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL5716005 0.84 EPHX2 (0.38) EPHX2ALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL6460674 0.83 ALDH1A1 (0.40) ALDH1A1TSHRCYP3A4KDM4ELMNA
SCHEMBL5715757 0.82 EPHX2 (0.35) EPHX2SMN1; SMN2MEN1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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