SCHEMBL10787192

SCHEMBL10787192

CCCC(C)CO.[BaH2]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL22659 0.97
SCHEMBL1203795 0.97
SCHEMBL7753346 0.97 TSHR (1.00)
SCHEMBL1204819 0.97
SCHEMBL10786900 0.94
Ammonia Solution, Strong SCHEMBL11075353 0.94 TSHR (0.94)
SCHEMBL10629921 0.94
SCHEMBL8617109 0.94
Alcohol SCHEMBL3854623 0.94 TSHR (0.94)
Ammonia Solution, Strong SCHEMBL11075783 0.94 TSHR (0.94)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0162908-A4 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS. LITHIUM CORP (US) 1986-04-15 EP claimed
EP-0162908-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-12-04 EP claimed
US-4555498-A Preparation of certain alkaline earth metal organometallic compounds LITHIUM CORPORATION OF AMERICA (US) 1985-11-26 US claimed
WO-1985002176-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-05-23 WO claimed
US-4634786-A INTERMEDIATES FOR ZIEGLER CATALYSTS LITHIUM CORPORATION OF AMERICA (US) 1987-01-06 US disclosed
EP-0162908-A4 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS. LITHIUM CORP (US) 1986-04-15 EP disclosed
EP-0162908-A4 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS. LITHIUM CORP (US) 1986-04-15 EP disclosed
EP-0162908-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-12-04 EP disclosed
EP-0162908-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-12-04 EP disclosed
US-4555498-A Preparation of certain alkaline earth metal organometallic compounds LITHIUM CORPORATION OF AMERICA (US) 1985-11-26 US disclosed
WO-1985002176-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-05-23 WO disclosed
WO-1985002176-A1 PREPARATION OF ALKALINE EARTH METAL ORGANOMETALLIC COMPOUNDS LITHIUM CORPORATION OF AMERICA (US) 1985-05-23 WO disclosed