SCHEMBL1582913

SCHEMBL1582913

CCCC(Cc1ccccc1Br)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.47
EPHX2 P34913 2/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 2/20 0.47
CHRM1 P11229 1/20 0.47
AKR1A1 P14550 1/20 0.47
CHRM3 P20309 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2C P28335 1/20 0.47
ADRA1A P35348 1/20 0.47
HRH1 P35367 1/20 0.47
DRD3 P35462 1/20 0.47
SLC6A3 Q01959 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PPARA Q07869 1/20 0.46
FOLH1 Q04609 3/20 0.46
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
PTGES O14684 2/20 0.43

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
SCHEMBL31046596 0.91 PPARG (0.53) PPARGPPARAFOLH1PTGESALOX5
SCHEMBL8904270 0.91 PPARG (0.53) PPARGPPARAFOLH1PTGESALOX5
Hydrochloric Acid SCHEMBL8719650 0.89 PPARG (0.52) PPARGPPARAFOLH1PTGESALOX5
SCHEMBL1511311 0.87 PPARG (0.49) PPARGEPHX2PPARACYP1A2RIPK1
SCHEMBL7386121 0.86 CYP1A2 (0.55) PPARGEPHX2PPARAFOLH1CPA3
SCHEMBL1582879 0.86 PPARG (0.42) PPARGEPHX2HDAC1HDAC2PPARA
SCHEMBL27515968 0.81 PPARG (0.47) PPARGEPHX2HDAC1HDAC2CHRM1
SCHEMBL1583003 0.81 ANPEP (0.47) PPARGPPARACYP1A2
Hydrochloric Acid SCHEMBL1583025 0.79 ANPEP (0.46) PPARGPPARACYP1A2
SCHEMBL4550704 0.78 CYP1A2 (0.70) PPARGEPHX2HDAC1HDAC2CHRM1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2000223-A None JP disclosed
EP-1070729-B1 Transition metal compound, olefin polymerization catalyst component comprising said compound, olefin polymerization catalyst containing said component, process for olefin polymerization using said catalyst, propylene homopolymer, propylene copolymer and propylene elastomer MITSUI CHEMICALS INC (JP) 2011-09-28 EP disclosed
EP-0812854-B2 Novel transition metal compound, olefin polymerization catalyst comprising said compound, process for olefin polymerization using said catalyst and propylene homo- and copolymer MITSUI CHEMICALS INC (JP) 2011-04-20 EP disclosed
CN-1166702-C Propylene Homopolymer, Propylene Copolymer and Propylene Elastomer 三井化学株式会社 2004-09-15 CN disclosed
CN-1104443-C Process for producing propylene polymer composition, and propylene polymer composition MITSUI PETROCHEMICAL IND (JP) 2003-04-02 CN disclosed
CN-1104444-C Process for the preparation of propylene polymer compositions MITSUI PETROCHEMICAL IND (JP) 2003-04-02 CN disclosed
EP-0812854-B1 Novel transition metal compound, olefin polymerization catalyst comprising said compound, process for olefin polymerization using said catalyst and propylene homo- and copolymer MITSUI CHEMICALS INC (JP) 2001-08-16 EP disclosed
EP-1070729-A2 Transition metal compound, olefin polymerization catalyst component comprising said compound, olefin polymerization catalyst containing said component, process for olefin polymerization using said catalyst, propylene homopolymer, propylene copolymer and propylene elastomer Mitsui Chemicals, Inc. (JP) 2001-01-24 EP disclosed
EP-0816395-B1 Process for preparing propylene polymer composition and propylene polymer composition MITSUI CHEMICALS INC (JP) 2000-07-19 EP disclosed
CN-1249312-A Propylene Homopolymer, Propylene Copolymer and Propylene Elastomer MITSUI CHEMICALS INC (JP) 2000-04-05 CN disclosed
EP-0812854-A2 Novel transition metal compound, olefin polymerization catalyst comprising said compound, process for olefin polymerization using said catalyst and propylene homo- and copolymer MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-12-17 EP disclosed
US-5658997-A USING ZIRCONIUM COMPOUND WITH ALUMINOXANE AND ORGANOALUMINUM COMPOUND MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-08-19 US disclosed
US-5629254-A Substituted indenyl ring containing metallocene catalyst for propylene polymerization process MITSUI PETROCHEMICAL INDUSTRIES CO., LTD. (JP) 1997-05-13 US disclosed
CN-1130915-A Process for producing propylene polymer composition, and propylene polymer composition MITSUI PETROCHEMICAL IND (JP) 1996-09-11 CN disclosed
CN-1122140-A Process for producing propylene polymer composition, and propylene polymer composition MITSUI PETROCHEMICAL IND (JP) 1996-05-08 CN disclosed
EP-0704463-A1 PROCESS FOR PRODUCING PROPYLENE POLYMER COMPOSITION, AND PROPYLENE POLYMER COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1996-04-03 EP disclosed
EP-0704462-A1 PROCESS FOR PRODUCING PROPYLENE POLYMER COMPOSITION, AND PROPYLENE POLYMER COMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1996-04-03 EP disclosed
CN-1103405-A Transition metal compound, olefin polymerization catalyst, olefin polymerization process, and propylene polymer MITSUI PETROCHEMICAL IND (JP) 1995-06-07 CN disclosed
EP-0629632-A2 Novel transition metal compound for use as a polymerization catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1994-12-21 EP disclosed
JP-H02223-A FURYL, PHENYLENE AND THIENTL LEUCOTRIENE B4 ANALOGUES G D SEARLE & CO 1990-01-05 JP disclosed