SCHEMBL5715908

SCHEMBL5715908

CCN(CF)c1ccc(F)cc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.43
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
MC4R P32245 1/20 0.33
PGR P06401 1/20 0.33
RIPK1 Q13546 2/20 0.33
TERT O14746 1/20 0.32
IDO1 P14902 1/20 0.32
AGXT P21549 1/20 0.32
ACKR3 P25106 1/20 0.32
MPO P05164 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
SCHEMBL5716046 0.90 CYP3A4 (0.46) CYP3A4CES2CES1DDB1CRBN
SCHEMBL5716600 0.85 CYP3A4 (0.35) CYP3A4CES2CES1DDB1CRBN
SCHEMBL5716580 0.85 PSEN1 (0.38) CYP3A4CES2CES1ALDH1A1KDM4E
SCHEMBL6790257 0.83 CYP3A4 (0.42) CYP3A4DDB1CRBNALDH1A1KDM4E
SCHEMBL6790822 0.80 CYP3A4 (0.40) CYP3A4MAPTMAPK1
SCHEMBL5716551 0.80 SOAT1 (0.37)
SCHEMBL13783927 0.78 DDB1 (0.40) CYP3A4DDB1CRBNALDH1A1MAPK1
SCHEMBL5715939 0.78 CNR2 (0.40) CYP3A4KDM4E
SCHEMBL5715896 0.76 DDB1 (0.43) CYP3A4DDB1CRBNALDH1A1KDM4E
SCHEMBL14566098 0.74 CYP3A4 (0.36) CYP3A4ALDH1A1KDM4EGAAMAPT

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