SCHEMBL9068682

SCHEMBL9068682

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

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.52
ACLY P53396 2/20 0.40
ALDH1A1 P00352 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSHR P16473 2/20 0.32
TP53 P04637 1/20 0.32
TET2 Q6N021 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
Ammonia Solution, Strong SCHEMBL516989 0.97 THRB (0.50) THRBACLYALDH1A1L3MBTL1TSHR
SCHEMBL28419714 0.85 THRB (0.59) THRBACLYALDH1A1L3MBTL1
SCHEMBL30772129 0.83 THRB (0.64) THRBACLYTET2
SCHEMBL756867 0.83 THRB (0.56) THRBACLYTET2
SCHEMBL5915248 0.81 THRB (0.62) THRBACLYALDH1A1L3MBTL1
SCHEMBL9145992 0.81 THRB (0.68) THRBACLYTET2
SCHEMBL3221510 0.81 THRB (0.48) THRBACLY
SCHEMBL28642164 0.79 THRB (0.67) THRBACLYALDH1A1L3MBTL1TET2
Ammonia Solution, Strong SCHEMBL517121 0.79 THRB (0.59) THRBACLYALDH1A1L3MBTL1
SCHEMBL63977 0.79 THRB (0.58) THRBACLYALDH1A1L3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113906293-A Mass spectrometry method using chromatography mass spectrometry device 株式会社新日本科学 2022-01-07 CN disclosed
CN-110869338-A Oxidation of alkanes to alkenes 斯克利普斯研究所 2020-03-06 CN disclosed
CN-110831916-A Direct oxidation of olefins to oxygenates 斯克利普斯研究所 2020-02-21 CN disclosed
US-5578415-A THIN FILM WITH LUSTER LAYER COMPRISING HYDROPHOBIC BINDER, METALLIC PARTICLES AND A TRANSPARENT PROTECTIVE FILM; LASER RECORDING, READING ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1996-11-26 US disclosed
EP-0361204-B1 Optical recording materials, method for preparing the same and optical cards having the same ASAHI CHEMICAL IND (JP) 1994-11-30 EP disclosed
EP-0557167-A1 Preparation of fluorinated functional compounds MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-08-25 EP disclosed
EP-0361204-A2 Optical recording materials, method for preparing the same and optical cards having the same Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1990-04-04 EP disclosed
US-3957672-A FLUORINATED POLYETHERS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1976-05-18 US disclosed