SCHEMBL5716617

SCHEMBL5716617

CCNCF.Fc1ccccc1-c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.33
ADORA1 P30542 3/20 0.33
ADORA3 P0DMS8 2/20 0.33
ADORA2B P29275 1/20 0.33
HSP90AA1 P07900 1/20 0.33
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 1/20 0.33
DHODH Q02127 2/20 0.32
GCGR P47871 1/20 0.32
GRIA4 P48058 1/20 0.32
MAPT P10636 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PSIP1 O75475 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ADRB2 P07550 1/20 0.31
TUBB4A P04350 1/20 0.31
TUBB P07437 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
SCHEMBL5716263 0.87 MAPK14 (0.33) ADORA2AADORA1ADORA3ADORA2BHSP90AA1
SCHEMBL5716203 0.85 ADRB2 (0.36) ADORA2AADORA1ADORA3ADORA2BHSP90AA1
SCHEMBL5716235 0.84 TAAR1 (0.40) ADORA2AADORA1ADORA3ADORA2BHSP90AA1
SCHEMBL5716567 0.82 SMN1; SMN2 (0.45) GCGRMEN1KMT2A
SCHEMBL5715595 0.81 ADORA2A (0.35) ADORA2AADORA1ADORA3ADORA2BHSP90AA1
SCHEMBL5716103 0.80 SMN1; SMN2 (0.46) GCGRMEN1KMT2A
SCHEMBL5715754 0.80 SMN1; SMN2 (0.46) GCGRMEN1KMT2A
SCHEMBL3794433 0.79 DHODH (0.41) ALDH1A1KDM4EDHODHMAPTL3MBTL1
SCHEMBL5715539 0.76 MEN1 (0.48) ALDH1A1GCGRMEN1KMT2A
SCHEMBL5716039 0.76 MEN1 (0.48) ALDH1A1GCGRMEN1KMT2A

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