SCHEMBL5080340

SCHEMBL5080340

COc1cc(C(C)C)c(O)c(C(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.58
CA2 P00918 3/20 0.58
GABRA1 P14867 6/20 0.54
GABRB1 P18505 5/20 0.54
GABRB2 P47870 3/20 0.54
GSR P00390 1/20 0.50
CYP3A4 P08684 2/20 0.46
FAAH O00519 1/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
GABRG2 P18507 1/20 0.46
PTGS1 P23219 1/20 0.46
SLC6A2 P23975 1/20 0.46
HTR2C P28335 1/20 0.46
GABRB3 P28472 1/20 0.46
GABRA5 P31644 1/20 0.46
GABRA3 P34903 1/20 0.46
HTR2B P41595 1/20 0.46

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
SCHEMBL4404238 0.81 THRA (0.47) CA1CA2GABRA1GABRB1HPGD
SCHEMBL8077435 0.81 GABRA1 (0.60) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL18524052 0.80 FABP3 (0.40) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL3433939 0.78 ALDH1A1 (0.48) CYP3A4CYP1A2BLMALDH1A1GAA
SCHEMBL11595855 0.77 CA1 (0.54) CA1CA2GABRA1GABRB1GABRB2
SCHEMBL2735020 0.76 ALDH1A1 (0.46) CYP3A4BLMALDH1A1GAA
SCHEMBL28450440 0.76 ALDH1A1 (0.46) GABRA1GABRB1CYP3A4CYP1A2BLM
SCHEMBL1494382 0.76 THRB (0.52) HPGDBLMALDH1A1THRATHRB
SCHEMBL2417164 0.74 GABRA1 (0.66) CA1CA2GABRA1GABRB1LMNA
SCHEMBL13057611 0.74 GAA (0.52) CA1CA2GABRA1GABRB1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4478989-A TITANIUM TRIHALIDE AND REACTION PRODUCT OF ORGANOALUMINUM COMPOUND AND AROMATIC HYDROXY COMPOUND SHELL OIL COMPANY (US) 1984-10-23 US claimed
US-9609747-B2 Wiring board FUJIFILM CORPORATION (JP) 2017-03-28 US disclosed
US-20160087208-A1 COMPOSITION FOR FORMING GATE INSULATING FILM, ORGANIC THIN FILM TRANSISTOR, ELECTRONIC PAPER, AND DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2016-03-24 US disclosed
US-20160071624-A1 ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC THIN-FILM TRANSISTOR, ELECTRONIC PAPER, AND DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2016-03-10 US disclosed
US-20160021741-A1 CONDUCTIVE FILM FORMING COMPOSITION, CONDUCTIVE FILM, AND WIRING BOARD FUJIFILM CORPORATION (JP) 2016-01-21 US disclosed
US-20150275029-A1 SEALING RESIN COMPOSITION, SEALING FILM, WIRING BOARD, TFT DEVICE, OLED DEVICE, AND LED DEVICE FUJIFILM CORPORATION (JP) 2015-10-01 US disclosed
US-20150195908-A1 WIRING BOARD FUJIFILM CORPORATION (JP) 2015-07-09 US disclosed
US-20080125531-A1 Polymerizable Composition, Thermoplastic Resin Composition, Crosslinked Resin, And Crosslinked Resin Composite Materials ZEON COROPRATION (JP) 2008-05-29 US disclosed
CN-100365039-C Polymerizable composition, thermoplastic resin composition, crosslinked resin, and crosslinked resin composite materials ZEON CORP (JP) 2008-01-30 CN disclosed
CN-1764681-A Polymerizable composition, thermoplastic resin composition, crosslinked resin, and crosslinked resin composite materials ZEON CORP (JP) 2006-04-26 CN disclosed
EP-1589054-A1 POLYMERIZABLE COMPOSITION, THERMOPLASTIC RESIN COMPOSITION, CROSSLINKED RESIN, AND CROSSLINKED RESIN COMPOSITE MATERIALS Zeon Corporation (JP) 2005-10-26 EP disclosed
EP-0498881-A4 INHIBITION OF BUTADIENE POLYMERIZATION DURING THE CONVERSION OF BUTADIENE TO VINYLCYCLOHEXENE 1993-07-28 EP disclosed
EP-0261727-B1 CATALYTIC SOLID TO BE USED IN STEREOSPECIFIC POLYMERIZATION OF ALPHA-OLEFINS, PROCESS FOR ITS PREPARATION AND PROCESS FOR POLYMERIZING ALPHA-OLEFINS IN ITS PRESENCE SOLVAY (BE) 1992-12-02 EP disclosed
EP-0498881-A1 INHIBITION OF BUTADIENE POLYMERIZATION DURING THE CONVERSION OF BUTADIENE TO VINYLCYCLOHEXENE THE DOW CHEMICAL COMPANY (US) 1992-08-19 EP disclosed
WO-1992004305-A1 INHIBITION OF BUTADIENE POLYMERIZATION DURING THE CONVERSION OF BUTADIENE TO VINYLCYCLOHEXENE THE DOW CHEMICAL COMPANY (US) 1992-03-19 WO disclosed
US-5043504-A Using hindered phenol as inhibitor and iron complex as catalyst THE DOW CHEMICAL COMPANY (US) 1991-08-27 US disclosed
EP-0261727-A1 Catalytic solid to be used in stereospecific polymerization of alpha-olefins, process for its preparation and process for polymerizing alpha-olefins in its presence SOLVAY (BE) 1988-03-30 EP disclosed
EP-0021478-B1 A PROCESS FOR THE STEREOSPECIFIC POLYMERIZATION OF AN ALPHA-OLEFIN AND AN ALPHA-OLEFIN POLYMERIZATION CATALYST SYSTEM SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1985-07-17 EP disclosed
US-4478989-A TITANIUM TRIHALIDE AND REACTION PRODUCT OF ORGANOALUMINUM COMPOUND AND AROMATIC HYDROXY COMPOUND SHELL OIL COMPANY (US) 1984-10-23 US disclosed