SCHEMBL4556848

SCHEMBL4556848

CC1=Cc2c(-c3ccc(C(F)(F)F)cc3)cccc2C1[Zr](Cl)Cl

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.33
ENPP1 P22413 1/20 0.33
CYP11B1 P15538 2/20 0.33
CYP11B2 P19099 2/20 0.33
DRD2 P14416 1/20 0.33
JAK2 O60674 1/20 0.33
APP P05067 1/20 0.32
EDNRB P24530 1/20 0.31
EDNRA P25101 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
BACE1 P56817 2/20 0.31
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
GABBR2 O75899 1/20 0.30
GABBR1 Q9UBS5 1/20 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
SCHEMBL7203232 0.88 BRD4 (0.35) RAB9ASMN1; SMN2
SCHEMBL27689410 0.88 KIF11 (0.34) KIF11ENPP1CYP11B1CYP11B2DRD2
Chloromethane SCHEMBL8460737 0.86 ENPP1 (0.32) KIF11ENPP1CYP11B1CYP11B2DRD2
Chloromethane SCHEMBL8465733 0.86 ENPP1 (0.32) KIF11ENPP1CYP11B1CYP11B2DRD2
SCHEMBL7199373 0.85 HTR2C (0.34) CYP11B2
SCHEMBL6889133 0.85 EDNRB (0.32) EDNRBEDNRA
SCHEMBL27463750 0.83 PTGS2 (0.33) EDNRBEDNRARAB9ASMN1; SMN2
SCHEMBL3163967 0.83 BRD4 (0.33) SIGMAR1
SCHEMBL27493782 0.83
SCHEMBL7934286 0.82 MAOA (0.30) RAB9ASMN1; SMN2MAOAMAOB

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-7618912-B2 Preparation of supported catalyst systems BASELL POLYOLEFINE GMBH (DE) 2009-11-17 US claimed
EP-1263847-A1 PROCESS FOR THE PREPARATION OF ADDITIVE COATED MOLDING POWDER Borealis Technology Oy (FI) 2002-12-11 EP disclosed
WO-2001062832-A1 PROCESS FOR THE PREPARATION OF ADDITIVE COATED MOLDING POWDER BOREALIS TECHNOLOGY OY (FI) 2001-08-30 WO disclosed
EP-1123319-A2 SUPPORTED POLYMERIZATION CATALYSTS Borealis Technology (FI) 2001-08-16 EP disclosed
WO-2000022011-A2 SUPPORTED POLYMERIZATION CATALYSTS BOREALIS TECHNOLOGY OY (FI) 2000-04-20 WO disclosed