Tetrahydrofuran

Tetrahydrofuran

SCHEMBL5656749

C1CCOC1.[Cl-].[Cl-].[Cl-].[Zr+3]C1=CC=CC1

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Tetrahydrofuran. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36

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
Hydrochloric Acid SCHEMBL258164 0.85
Bromide SCHEMBL28567998 0.83
Hydrochloric Acid SCHEMBL15667924 0.83
Hydrochloric Acid SCHEMBL9842073 0.83
Hydrochloric Acid SCHEMBL8028200 0.83
SCHEMBL8662228 0.80
Fluoride Ion SCHEMBL1130827 0.80
Bromide SCHEMBL1539628 0.80
Iodide SCHEMBL1539773 0.80
Hydrochloric Acid SCHEMBL7638505 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1248676-A4 OLEFIN POLYMERIZATION CATALYSTS CONTAINING MODIFIED BORRAARYL LIGANDS EQUISTAR CHEM LP (US) 2006-06-07 EP disclosed
US-6790805-B2 COORDINATION CATALYST EQUISTAR CHEMICALS, LP 2004-09-14 US disclosed
EP-1189698-A4 PROCESS FOR THE IN-SITU PREPARATION OF SINGLE-SITE TRANSITION METAL CATALYSTS AND POLYMERIZATION PROCESS EQUISTAR CHEM LP (US) 2002-10-16 EP disclosed
EP-1248676-A1 OLEFIN POLYMERIZATION CATALYSTS CONTAINING MODIFIED BORRAARYL LIGANDS Equistar Chemicals L.P. (US) 2002-10-16 EP disclosed
EP-1189698-A1 PROCESS FOR THE IN-SITU PREPARATION OF SINGLE-SITE TRANSITION METAL CATALYSTS AND POLYMERIZATION PROCESS Equistar Chemicals L.P. (US) 2002-03-27 EP disclosed
US-20020010075-A1 Process for the in-situ preparation of single-site transition metal catalysts and polymerization process EQUISTAR CHEMICALS, LP 2002-01-24 US disclosed
US-6294626-B1 USEFUL FOR THE PREPARATION OF MULTIMODAL POLYOLEFINS HAVING SEPARATE COMPONENTS OF DISTINCT MOLECULAR WEIGHT EQUISTAR CHEMICALS, LP 2001-09-25 US disclosed
US-6291386-B1 Process for the in-situ preparation of single-site transition metal catalysts and polymerization process EQUISTAR CHEMICALS, LP 2001-09-18 US disclosed
WO-2001036089-A1 OLEFIN POLYMERIZATION CATALYSTS CONTAINING MODIFIED BORRAARYL LIGANDS EQUISTAR CHEMICALS, L.P. (US) 2001-05-25 WO disclosed
WO-2000071251-A1 PROCESS FOR THE IN-SITU PREPARATION OF SINGLE-SITE TRANSITION METAL CATALYSTS AND POLYMERIZATION PROCESS EQUISTAR CHEMICALS, L.P. (US) 2000-11-30 WO disclosed