SCHEMBL16715281

SCHEMBL16715281

CCCCCCCC[PH+](C)C.Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL16715270 0.89 TSHR (0.31) TSHRTHRB
SCHEMBL16715258 0.86 TSHR (0.32) TSHRTHRB
SCHEMBL16715259 0.86 TSHR (0.32) TSHRTHRB
SCHEMBL7723234 0.86 TSHR (0.32) TSHRTHRB
Octane SCHEMBL29076189 0.85 TSHR (0.42) TSHRTHRB
Octane SCHEMBL23754699 0.83 TSHR (0.40) TSHRTHRB
SCHEMBL25206688 0.79 TSHR (0.36) TSHRTHRB
SCHEMBL4581617 0.79 TSHR (0.36) TSHRTHRB
SCHEMBL7733232 0.79 TSHR (0.36) TSHRTHRB
SCHEMBL3010797 0.79 TSHR (0.33) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115989233-A Ligand compound, organic chromium compound and catalyst system comprising same 株式会社LG化学 2023-04-18 CN disclosed
WO-2022060108-A1 LIGAND COMPOUND, ORGANIC CHROMIUM COMPOUND, AND CATALYST SYSTEM COMPRISING SAME 주식회사 엘지화학 2022-03-24 WO disclosed
US-9035119-B2 Oligomerisation of olefinic compounds in the presence of an activated oligomerisation catalyst SASOL TECHNOLOGY (PTY) LIMITED (ZA) 2015-05-19 US disclosed