SCHEMBL9017267

SCHEMBL9017267

O=C(O)C(F)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.62
ALDH1A1 P00352 1/20 0.36
ACLY P53396 2/20 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
SCHEMBL2891336 0.93 THRB (0.74) THRBALDH1A1ACLY
Ammonia Solution, Strong SCHEMBL810619 0.91 THRB (0.56) THRBALDH1A1ACLY
SCHEMBL7263035 0.91 THRB (0.56) THRBALDH1A1ACLY
SCHEMBL7262110 0.89 THRB (0.60) THRBALDH1A1ACLY
SCHEMBL15792486 0.89 THRB (0.60) THRBALDH1A1ACLY
SCHEMBL2894825 0.89 THRB (0.60) THRBALDH1A1ACLY
SCHEMBL23610940 0.88 THRB (0.52) THRBALDH1A1ACLY
Ammonia Solution, Strong SCHEMBL30261829 0.86 THRB (0.50) THRBALDH1A1ACLY
SCHEMBL29355653 0.86 THRB (0.56) THRBALDH1A1ACLY
SCHEMBL15792295 0.84 THRB (0.52) THRBALDH1A1ACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5482650-A Liquid crystal compounds having perfluoroether terminal portions MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1996-01-09 US disclosed
US-5437812-A Achiral and having low-temperature smectic mesophases or or latent smectic mesophases; used in mixtures with fluorinated liquid crystals; low birefringence and viscosity; high speed switches; stability MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-08-01 US disclosed