SCHEMBL6857282

SCHEMBL6857282

C[SiH](C)[Ti](C)(C)(NC(=O)C1CCCCC1)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 2/20 0.37
P2RX7 Q99572 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 2/20 0.36
HDAC1 Q13547 2/20 0.36
HDAC2 Q92769 2/20 0.36
CETP P11597 1/20 0.36
HDAC3 O15379 1/20 0.36
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PNMT P11086 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 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
SCHEMBL5853698 0.86 NPC1 (0.39) NPC1RAB9ACYP2C19ALDH1A1KDM4E
SCHEMBL5856430 0.86 NPC1 (0.39) NPC1RAB9ACYP2C19ALDH1A1KDM4E
SCHEMBL5852882 0.85 NPC1 (0.40) NPC1RAB9ACYP2C19ALDH1A1KDM4E
SCHEMBL7629923 0.84 NPC1 (0.38) NPC1RAB9ACYP2C19ALDH1A1KDM4E
SCHEMBL7636915 0.83 ALDH1A1 (0.39) NPC1RAB9ACYP2C19ALDH1A1KDM4E
SCHEMBL5853361 0.79 HPGD (0.37) NPC1RAB9ACYP2C19ALDH1A1SMN1; SMN2
SCHEMBL5855923 0.79 HPGD (0.37) NPC1RAB9ACYP2C19ALDH1A1SMN1; SMN2
SCHEMBL5854050 0.77 NPC1 (0.37) NPC1RAB9ACYP2C19ALDH1A1HPGD
SCHEMBL28486127 0.73 NPC1 (0.42) NPC1RAB9APNMTHTR7HTR2B
SCHEMBL9587137 0.72 NPC1 (0.41) NPC1RAB9ACYP2C19ALDH1A1KDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6787617-B1 FORMING NARROW MOLECULAR WEIGHT HOMOPOLYMERS AS INTERMEDIATES TO BLOCK OR TERMINAL FUNCTIONALIZED POLYMERS; HAFNIUM OR ZIRCONIUM CYCLOPENTADIENYL FUNCTIONALIZED CATALYSTS WITH TRIPHENYLBORON AND TRIALKYLALUMINUM COMPOUNDS JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF THE AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2004-09-07 US disclosed
EP-0849288-B1 Catalyst for polymerization of an olefin, and method for producing an olefin polymer TOSOH CORP (JP) 2002-11-27 EP disclosed
EP-1209171-A1 PROCESS FOR PRODUCING OLEFIN LIVING POLYMER JAPAN as Represented by DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2002-05-29 EP disclosed
US-5906955-A Catalyst for polymerization of an olefin, and method for producing an olefin polymer TOSOH CORPORATION (JP) 1999-05-25 US disclosed
EP-0849288-A1 Catalyst for polymerization of an olefin, and method for producing an olefin polymer TOSOH CORPORATION (JP) 1998-06-24 EP disclosed