SCHEMBL4611989

SCHEMBL4611989

Cc1ccc2c(c1)C=CC2CCC1C=Cc2cc(C)ccc21

nearest known ligand 0.33

Predicted protein targets (top 17)

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 0.32
HTR6 P50406 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
CYP1A2 P05177 2/20 0.31
CYP2A6 P11509 2/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 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
SCHEMBL5604681 0.98 HDAC3 (0.33) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL9146492 0.86 HDAC3 (0.33) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL10592420 0.85 HDAC3 (0.35) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL6439357 0.84 HTR6 (0.32) HTR6CHRNB2CHRNA4CYP1A2CYP2A6
SCHEMBL9145846 0.83 HDAC3 (0.32) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL9146416 0.83 HDAC3 (0.32) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL11224804 0.77 HTR6 (0.41) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL9074416 0.76 HDAC3 (0.48) HDAC3HDAC1HDAC7HDAC2HDAC8
Hydrochloric Acid SCHEMBL11220602 0.76 HTR6 (0.40) HDAC3HDAC1HDAC7HDAC2HDAC8
SCHEMBL29476027 0.75 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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0575123-B2 Ethylene copolymer composition MITSUI CHEMICALS INC (JP) 2008-02-13 EP disclosed
US-6894120-B2 Ethylene copolymer composition MITSUI CHEMICALS, INC. (JP) 2005-05-17 US disclosed
US-20040210004-A1 Ethylene copolymer composition TAKAHASHI MAMORU (JP) 2004-10-21 US disclosed
US-6774190-B1 LOW DENSITY POLYETHYLENE OBTAINED BY HIGH-PRESSURE FREE RADICAL POLYMERIZATION; HEAT RESISTANCE, STABILITY, MOLDABILITY, AND TRANSPARENCY; ANTI-BLOCKING RESISTANCE MITSUI CHEMICALS, INC. (JP) 2004-08-10 US disclosed
US-20030092845-A1 Ethylene copolymer composition TAKAHASHI MAMORU (JP) 2003-05-15 US disclosed
US-20020165322-A1 Ethylene copolymer composition TAKAHASHI MAMORU (JP) 2002-11-07 US disclosed
US-20020143126-A1 Ethylene resin injection molded articles TAKAHASHI MAMORU (JP) 2002-10-03 US disclosed
US-6319961-B1 ETHYLENE/ALPHA-OLEFIN COPOLYMER; DENSITY IS 0.880-0.940 G/CM3; MELT FLOW RATE AT 190 DEGREES C. UNDER A 2.16 KG LOAD IS 0.1-20 G/10 MIN MITSUI CHEMICALS INC (JP) 2001-11-20 US disclosed
EP-0575123-B1 Ethylene copolymer composition MITSUI CHEMICALS INC (JP) 2000-08-30 EP disclosed
US-5674945-A Ethylene copolymer composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-10-07 US disclosed
EP-0587365-B1 Ethylene copolymer composition MITSUI PETROCHEMICAL IND (JP) 1997-04-23 EP disclosed
US-5594071-A HEAT RESISTANCE, MOLDABILITY MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-01-14 US disclosed
US-5545785-A Process for preparing biscyclopentadienyl compounds WITCO GMBH (DE) 1996-08-13 US disclosed
US-5474716-A Process for the preparation of bridged cyclopentadienylmagnesium compounds and use thereof for preparing metallocenes WITCO GMBH (DE) 1995-12-12 US disclosed
US-5453221-A Bridged cyclopentadienylmagnesium compounds and use thereof for preparing metallocenes WITCO GMBH (DE) 1995-09-26 US disclosed
US-5371146-A A blends of ethylene-(alpha)olefins copolymers has high transparency, high strength, blocking resistance, good melt flowability and tension MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-12-06 US disclosed
EP-0587365-A2 Ethylene copolymer composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-03-16 EP disclosed