SCHEMBL5604681

SCHEMBL5604681

Cc1ccc2c(c1)C=CC2CCC1C=Cc2cc(C)ccc21.[LiH].[LiH]

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
ACHE P22303 1/20 0.31
HTR6 P50406 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 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
SCHEMBL4611989 0.98 HDAC3 (0.33) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL9146416 0.85 HDAC3 (0.32) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL9146492 0.85 HDAC3 (0.33) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL10592420 0.83 HDAC3 (0.35) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL6439357 0.82 HTR6 (0.32) HTR6CHRNB2CHRNA4CYP1A2CYP2A6
SCHEMBL9145846 0.81 HDAC3 (0.32) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL11224804 0.75 HTR6 (0.41) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL9074416 0.74 HDAC3 (0.48) HDAC3HDAC1HDAC7HDAC2HDAC8
Hydrochloric Acid SCHEMBL11220602 0.74 HTR6 (0.40) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL8766062 0.74 ACHE (0.35) ACHECHRNB2CHRNA4CYP1A2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7160949-B2 Olefin block copolymers, processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2007-01-09 US disclosed
EP-1275670-B1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF MITSUI CHEMICALS INC (JP) 2005-08-10 EP disclosed
US-20030055179-A1 Olefin block copolymers processes for producing the same and uses thereof MITSUI CHEMICALS, INC. (JP) 2003-03-20 US disclosed
EP-1275670-A1 OLEFIN BLOCK COPOLYMERS, PRODUCTION PROCESSES OF THE SAME AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2003-01-15 EP disclosed
EP-0452920-B1 Process for the preparation of an ethylene copolymer and an olefin polymer, and catalysts for olefin polymerization MITSUI CHEMICALS INC (JP) 2001-10-10 EP disclosed
US-5883205-A ETHYLENE POLYMERIZATION IN SUSPENSION OR VAPOR PHASE WITH CATALYST OF CYCLOPENTADIENE, TRANSITION METAL, ORGANOALUMINUM OXY COMPOUND MITSUI CHEMICALS, INC. (JP) 1999-03-16 US disclosed
US-5840815-A POLYMERIZING OLEFIN IN PRESENCE OF SOLID CATALYST FORMED FROM COMPOUND OF GROUP IVB METAL HAVING CYCLOPENTADIENE-BASED LIGANDS, ORGANOALUMINUM OXY-COMPOUND MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1998-11-24 US disclosed
US-5374700-A Copolymers with alpha-olefins having controlled density, melt tension, physical properties, stoichiometry MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-12-20 US disclosed
EP-0452920-A2 Process for the preparation of an ethylene copolymer and an olefin polymer, and catalysts for olefin polymerization MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-10-23 EP disclosed