SCHEMBL6226983

SCHEMBL6226983

C1=CCC([Zr](=C2CC2)C2c3ccc(-c4ccccc4)cc3-c3cc(-c4ccccc4)ccc32)=C1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.32
KDM1B Q8NB78 1/20 0.32
TYRO3 Q06418 1/20 0.31
NTRK2 Q16620 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
DYRK1B Q9Y463 1/20 0.31
CAMK2A Q9UQM7 1/20 0.30
EDNRB P24530 1/20 0.30
EDNRA P25101 1/20 0.30
PARP10 Q53GL7 1/20 0.30
PARP11 Q9NR21 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL6226357 0.95 CAMK2A (0.32) KDM1AKDM1BTYRO3NTRK2CLK4
SCHEMBL6227860 0.94 CAMK2A (0.31) KDM1AKDM1BCAMK2AKDM4EMEN1
SCHEMBL7735606 0.85 CAMK2A (0.32) CAMK2APARP10PARP11
SCHEMBL7733091 0.85 PARP10 (0.32) PARP10PARP11
SCHEMBL7733859 0.84 PARP10 (0.31) PARP10PARP11
SCHEMBL6227342 0.81
SCHEMBL6233610 0.81 CNR1 (0.34) ALDH1A1
SCHEMBL6003783 0.80 ACHE (0.31)
SCHEMBL4500839 0.80
SCHEMBL7724795 0.78

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-2511305-A1 Bridged metallocene compound for olefin polymerization and method of polymerizing olefin using the same Mitsui Chemicals, Inc. (JP) 2012-10-17 EP disclosed
EP-2465879-A1 Bridged metallocene compound for olefin polymerization and method of polymerizing olefin using the same Mitsui Chemicals, Inc. (JP) 2012-06-20 EP disclosed
EP-2465878-A1 Bridged metallocene compound for olefin polymerization and method of polymerizing olefin using the same Mitsui Chemicals, Inc. (JP) 2012-06-20 EP disclosed
EP-1548018-A1 CROSSLINKED METALLOCENE COMPOUND FOR OLEFIN POLYMERIZATION AND METHOD OF POLYMERIZING OLEFIN WITH THE SAME Mitsui Chemicals, Inc. (JP) 2005-06-29 EP disclosed