SCHEMBL5716446

SCHEMBL5716446

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

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
HRH4 Q9H3N8 3/20 0.36
HRH3 Q9Y5N1 3/20 0.36
LMNA P02545 1/20 0.36
S1PR2 O95136 1/20 0.35
S1PR1 P21453 1/20 0.35
S1PR3 Q99500 1/20 0.35
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
CHRM2 P08172 1/20 0.33

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
SCHEMBL5716247 0.98 EPHX2 (0.46) EPHX2SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL5715671 0.95 EPHX2 (0.44) EPHX2SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL5716005 0.95 EPHX2 (0.38) EPHX2SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL5716452 0.92 EPHX2 (0.37) EPHX2SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL5715753 0.91 EPHX2 (0.43) EPHX2SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL5716271 0.89 TSHR (0.44) EPHX2SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL5715944 0.87 EPHX2 (0.38) EPHX2SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL6439619 0.85 EPHX2 (0.36) EPHX2SMN1; SMN2KMT2AMEN1TSHR
SCHEMBL5716022 0.84 EPHX2 (0.38) EPHX2SMN1; SMN2KMT2AMEN1HRH4
SCHEMBL5716192 0.82 EPHX2 (0.40) EPHX2SMN1; SMN2KMT2AMEN1

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