SCHEMBL5716136

SCHEMBL5716136

Cc1c(F)c(F)c(F)c(N2CCCCC2)c1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA7 P43166 2/20 0.48
CA13 Q8N1Q1 2/20 0.48
CA9 Q16790 1/20 0.48
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRM3 P20309 6/20 0.32
PDE4A P27815 4/20 0.32
PDE4B Q07343 4/20 0.32
PDE4C Q08493 4/20 0.32
PDE4D Q08499 4/20 0.32
TSHR P16473 1/20 0.32
TAS1R3 Q7RTX0 3/20 0.30
TAS1R1 Q7RTX1 2/20 0.30
TAS1R2 Q8TE23 2/20 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
SCHEMBL5716012 0.98 CA12 (0.46) CA12CA1CA2CA7CA13
SCHEMBL5716127 0.86 CA12 (0.59) CA12CA1CA2CA7CA13
SCHEMBL21675441 0.84 ALDH1A1 (0.46) CA12CA1CA2CA7CA13
SCHEMBL5716130 0.83 ALDH1A1 (0.56) CA12CA1CA2CA7CA13
Hydrochloric Acid SCHEMBL7605265 0.81 ALDH1A1 (0.61) CA12CA1CA2CA7CA13
SCHEMBL5715977 0.78 ALDH1A1 (0.56) CA12CA1CA2CA7CA13
SCHEMBL31034606 0.75 CA12 (0.48) CA12CA1CA2CA7CA13
SCHEMBL24893440 0.74 CA12 (0.55) CA12CA1CA2CA7CA13
SCHEMBL3923985 0.74 ALDH1A1 (0.72) ALDH1A1LMNA
SCHEMBL237255 0.73 CA12 (0.57) CA12CA1CA2CA7CA13

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 7 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
US-6822057-B2 OLEFIN POLYMERIZATION CATALYST SYSTEM IS A REACTION PRODUCT OF A METALLOCENES AND A COCATALYST CONTAINING FLUOROARYL SUBSTITUTED SECONDARY AMINE OR PHSOPHINE COMPOUND AND AN ANION CONTAINING GROUP 13 ELEMENT WHICH IS NONCOORDINATIG EXXON MOBIL CHEMICAL PATENTS INC. 2004-11-23 US disclosed
CN-1413217-A Olefin polymerization catalyst derived from group 15 containing cationic compounds and methods of using the same EXXON CHEMICAL PATENTS INC (US) 2003-04-23 CN disclosed
US-6489480-B2 COORDINATION POLYMERIZATION CATALYST FOR ALPHA-OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2002-12-03 US disclosed
US-20020115806-A1 Olefin polymerization catalysts derived from Group-15 cationic compounds and processes using them EXXONMOBIL CHEMICAL PATENTS INC. 2002-08-22 US disclosed
US-20020111265-A1 GROUP-15 CATIONIC COMPOUNDS FOR OLEFIN POLYMERIZATION CATALYSTS EXXONMOBIL CHEMICAL PATENTS INC. 2002-08-15 US disclosed