SCHEMBL4260552

SCHEMBL4260552

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

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.32
FFAR3 O14843 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CES2 O00748 1/20 0.31
FAAH O00519 1/20 0.30

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
Fluoride SCHEMBL27756652 0.97 TDP1 (0.30) TDP1FFAR3ALDH1A1CES2
SCHEMBL31621226 0.80 CES1 (0.38) FFAR3ALDH1A1CES2FAAH
SCHEMBL28144570 0.79
SCHEMBL26821925 0.76 TDP1 (0.33) TDP1FFAR3ALDH1A1CES2FAAH
SCHEMBL7553872 0.76 TDP1 (0.33) TDP1FFAR3ALDH1A1
SCHEMBL8380538 0.74 TDP1 (0.38) TDP1FFAR3ALDH1A1CES2FAAH
SCHEMBL14665160 0.74 TDP1 (0.38) TDP1FFAR3ALDH1A1CES2FAAH
SCHEMBL14322133 0.74 TDP1 (0.32) TDP1FFAR3ALDH1A1
SCHEMBL31329103 0.72 GAA (0.52) ALDH1A1
SCHEMBL17570466 0.72 CA1 (0.31) TDP1FFAR3ALDH1A1

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-4214457-A1 LOW-PRESSURE HEAT PIPES AND HEAT TRANSFER METHODS USING LOW-PRESSURE FOR HEAT PIPES Honeywell International Inc. (US) 2023-07-26 EP disclosed
WO-2022061127-A1 LOW-PRESSURE HEAT PIPES AND HEAT TRANSFER METHODS USING LOW-PRESSURE FOR HEAT PIPES HONEYWELL INTERNATIONAL INC. (US) 2022-03-24 WO disclosed
EP-2825267-A2 FIRE SUPPRESSING MATERIALS AND SYSTEMS AND METHODS OF USE Meggitt Safety Systems, Inc. (US) 2015-01-21 EP disclosed
WO-2014007862-A2 FIRE SUPPRESSING MATERIALS AND SYSTEMS AND METHODS OF USE MEGGITT SAFETY SYSTEMS, INC. (US) 2014-01-09 WO disclosed
EP-2010596-A2 BLOWING AGENT COMPOSITION Arkema France (FR) 2009-01-07 EP disclosed
CN-101184821-A Compositions comprising 3,3,4,4,5,5,6,6,6-nonafluoro-1-hexene DU PONT (US) 2008-05-21 CN disclosed
EP-1904600-A2 COMPOSITIONS COMPRISING 3,3,4,4,5,5,6,6,6-NONAFLUORO-1-HEXENE E.I. DUPONT DE NEMOURS AND COMPANY (US) 2008-04-02 EP disclosed
WO-2007113434-A2 BLOWING AGENT COMPOSITION ARKEMA FRANCE (FR) 2007-10-11 WO disclosed
WO-2006130406-A2 COMPOSITIONS COMPRISING 3,3,4,4,5,5,6,6,6-NONAFLUORO-1-HEXENE E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-12-07 WO disclosed
US-20060266975-A1 Compositions comprising 3,3,4,4,5,5,6,6,6-nonafluoro-1-hexene E. I. DU PONT DE NEMOURS AND COMPANY 2006-11-30 US disclosed