SCHEMBL27463589

SCHEMBL27463589

CCCC1=Cc2c(-c3ccccc3)cccc2C1[Zr]

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.33
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
HTR7 P34969 3/20 0.31
HTR1A P08908 2/20 0.31
CYP2A6 P11509 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
BCHE P06276 1/20 0.30
ACHE P22303 1/20 0.30
DRD2 P14416 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
Hydrochloric Acid SCHEMBL28035007 0.97 ADRB2 (0.32) ADRB2PDCD1CD274
SCHEMBL27446696 0.92 BCHE (0.35) PDCD1CD274SMN1; SMN2BCHEACHE
SCHEMBL27736995 0.90 CRHR1 (0.33)
SCHEMBL27687600 0.89 CNR1 (0.36)
Hydrochloric Acid SCHEMBL28035059 0.89 BCHE (0.33) BCHEACHE
SCHEMBL6649301 0.88 PDCD1 (0.33) ADRB2PDCD1CD274HTR7CHRNB2
SCHEMBL27736952 0.87 EDNRB (0.34)
Hydrochloric Acid SCHEMBL28034369 0.87 CNR1 (0.35)
SCHEMBL28313074 0.87 PDCD1 (0.33) ADRB2PDCD1CD274CHRNB2CHRNA4
SCHEMBL28313073 0.87 PDCD1 (0.33) ADRB2PDCD1CD274CHRNB2CHRNA4

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
CN-101124252-B Metallocene catalysts, their synthesis and use in olefin polymerization NOVOLEN TECH HOLDINGS CV 2011-10-05 CN claimed
CN-101124252-A Metallocene catalysts, their synthesis and use in olefin polymerization NOVOLEN TECH HOLDINGS CV (NL) 2008-02-13 CN claimed
CN-103012623-A Metallocene catalysts, their synthesis and their use for the polymerization of olefins NOVOLEN TECH HOLDINGS CV 2013-04-03 CN disclosed
CN-101124252-B Metallocene catalysts, their synthesis and use in olefin polymerization NOVOLEN TECH HOLDINGS CV 2011-10-05 CN disclosed
CN-101356199-A Method for producing ultra-high molecular weight polymers by means of special bridged metallocene catalysts TICONA GMBH (DE) 2009-01-28 CN disclosed
CN-101124252-A Metallocene catalysts, their synthesis and use in olefin polymerization NOVOLEN TECH HOLDINGS CV (NL) 2008-02-13 CN disclosed
CN-1137148-C Catalyst system ��������ϩ����������޹�˾ 2004-02-04 CN disclosed