SCHEMBL5715940

SCHEMBL5715940

Cc1c(F)c(F)c(F)c(N2CCc3ccccc32)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
HPGD P15428 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
TSHR P16473 3/20 0.43
SRD5A1 P18405 2/20 0.43
ALOX15 P16050 3/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 2/20 0.42
MAPK1 P28482 2/20 0.42
MAPT P10636 1/20 0.42
HSD17B10 Q99714 1/20 0.39
ROCK1 Q13464 1/20 0.39
BRCA1 P38398 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
USP2 O75604 1/20 0.39
CDK4 P11802 1/20 0.39

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
SCHEMBL5715497 0.90 ALDH1A1 (0.53) ALDH1A1NPC1RAB9AHPGDRXFP1
SCHEMBL30874673 0.79 ALDH1A1 (0.52) ALDH1A1NPC1RAB9AHPGDRXFP1
SCHEMBL27588192 0.76 ALDH1A1 (0.44) ALDH1A1NPC1RAB9AHPGDRXFP1
SCHEMBL27588112 0.74 ALDH1A1 (0.45) ALDH1A1NPC1RAB9AHPGDRXFP1
SCHEMBL5716049 0.71 ALDH1A1 (0.44) ALDH1A1NPC1RAB9AHPGDSMN1; SMN2
SCHEMBL5716185 0.71 ALDH1A1 (0.48) ALDH1A1NPC1RAB9AHPGDRXFP1
SCHEMBL25026229 0.71 ALDH1A1 (0.55) ALDH1A1HPGDSMN1; SMN2TSHRSRD5A1
SCHEMBL8934707 0.70 SMN1; SMN2 (0.49) ALDH1A1HPGDSMN1; SMN2TSHRSRD5A1
SCHEMBL5716298 0.70 ALDH1A1 (0.50) ALDH1A1NPC1RAB9AHPGDRXFP1
SCHEMBL17179753 0.69 SMN1; SMN2 (0.48) ALDH1A1NPC1RAB9AHPGDRXFP1

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