SCHEMBL4577361

SCHEMBL4577361

CC(C)=[Zr+2](C1=CC=CC1)C1c2ccccc2-c2ccccc21.[H-].[H-]

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
GPR3 P46089 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
Bromide SCHEMBL7205887 0.97 POLB (0.33) POLBGPR3
Fluoride Ion SCHEMBL1130886 0.97 POLB (0.33) POLBGPR3
Hydrochloric Acid SCHEMBL78567 0.97 POLB (0.33) POLBGPR3
Hydrochloric Acid SCHEMBL6553975 0.87 PPIA (0.35)
Hydrochloric Acid SCHEMBL6555613 0.84
Hydrochloric Acid SCHEMBL7719195 0.84 PDK2 (0.31)
Syringol SCHEMBL7930374 0.84 NR3C1 (0.32)
Hydrochloric Acid SCHEMBL7717009 0.84 GAA (0.35) GPR3
Hydrochloric Acid SCHEMBL1135091 0.83 KDM4E (0.30)
Hydrochloric Acid SCHEMBL1135043 0.83 KDM4E (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7332551-B2 Partially fluorinated naphthyl-based borates EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-02-19 US disclosed
EP-1448568-A4 DICOPS CONTAINING ACETYLENIC SUBSTITUENTS EXXONMOBIL CHEM PATENTS INC (US) 2008-02-13 EP disclosed
US-7077977-B2 Bulky borate activations EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-07-18 US disclosed
US-6909008-B2 Cocatalyst compositions EXXONMOBIL CHEMICAL PATENTS INC. (US) 2005-06-21 US disclosed
US-20050049436-A1 Partially fluorinated naphthyl-based borates EXXONMOBIL CHEMICAL PATENTS INC. 2005-03-03 US disclosed
US-20040254065-A1 Bulky borate activations EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-16 US disclosed
US-20040199021-A1 DICOPS CONTAINING ACETYLENIC SUBSTITUENTS EXXONMOBIL CHEMICAL PATENTS INC. 2004-10-07 US disclosed
EP-1461152-A1 BULKY BORATE ACTIVATORS ExxonMobil Chemical Patents Inc. (US) 2004-09-29 EP disclosed
EP-1448568-A2 DICOPS CONTAINING ACETYLENIC SUBSTITUENTS ExxonMobil Chemical Patents Inc. (US) 2004-08-25 EP disclosed
US-20040152591-A1 Polymerized metallocene catalyst composition EXXONMOBIL CHEMICAL PATENTS, INC. 2004-08-05 US disclosed
US-5973084-A HOMO OR COPOLYMERIZING AN ALPHA-OLEFIN IN PRESENCE OF A CATALYTIC SYSTEM CONTAINING METALLOCENE TYPE TRANSITIONAL METAL COMPOUND, AN ION EXCHANGED LAYERED COMPOUND OTHER THAN SILICATE AND AN INORGANIC ACID OR SALT TREATED SILICATE MITSUBISHI CHEMICAL CORPORATION (JP) 1999-10-26 US disclosed
US-5928982-A METALLOCENE TRANSITION METAL COMPOUND, (1) AN ION-EXCHANGING LAYERED COMPOUND OTHER THAN A SILICATE OR (2) AN INORGANIC SILICATE PREPARED BY TREATING A STARTING ION-EXCHANGING LAYER COMPOUND OTHER THAN A SILICATE OR A STARTING SILICATE WITH A MITSUBISHI CHEMICAL CORPORATION (JP) 1999-07-27 US disclosed
EP-0874006-A1 Polymerisation of olefins MITSUBISHI CHEMICAL CORPORATION (JP) 1998-10-28 EP disclosed
EP-0511665-B1 Catalyst for polymerizing an olefin and method for producing an olefin polymer MITSUBISHI CHEM CORP (JP) 1998-07-22 EP disclosed
EP-0839842-A2 Ethylene-alpha-olefin copolymer MITSUBISHI CHEMICAL CORPORATION (JP) 1998-05-06 EP disclosed
EP-0778293-A2 Process for producing olefin polymer MITSUBISHI CHEMICAL CORPORATION (JP) 1997-06-11 EP disclosed
EP-0698621-A1 Catalyst for polymerizing an olefin and method for producing an olefin polymer MITSUBISHI CHEMICAL CORPORATION (JP) 1996-02-28 EP disclosed
EP-0683180-A2 Catalyst for polymerizing an olefin and method for polymerizing the olefin MITSUBISHI CHEMICAL CORPORATION (JP) 1995-11-22 EP disclosed
US-5308811-A Catalyst for polymerizing an olefin and method for producing an olefin polymer MITSUBISHI KASEI CORPORATION (JP) 1994-05-03 US disclosed
EP-0511665-A2 Catalyst for polymerizing an olefin and method for producing an olefin polymer Mitsubishi Chemical Corporation (JP) 1992-11-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040199021-A1 DICOPS CONTAINING ACETYLENIC SUBSTITUENTS AADAC, NAA15, ALG8 POLB 2909/4885GPR3 3176/4885
US-20050049436-A1 Partially fluorinated naphthyl-based borates NBAS, TNK1, POF1B POLB 522/4885GPR3 992/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.