Ethyl Chloride

Ethyl Chloride

SCHEMBL1052272

CCCl.O=C(O)F.O=C(O)F.O=C(O)F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.44
TSHR P16473 3/20 0.44
HDAC1 Q13547 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC3 O15379 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
ALDH1A1 P00352 4/20 0.35
TDP1 Q9NUW8 3/20 0.35
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
CHRM1 P11229 1/20 0.32
AKR1A1 P14550 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
AKR1B1 P15121 1/20 0.32

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
Propane SCHEMBL28341044 0.84 FFAR3 (0.50) FFAR3TSHRHDAC1HDAC2HDAC3
Bicarbonate SCHEMBL28280718 0.84
Bicarbonate SCHEMBL9303939 0.84 FFAR3 (0.50) FFAR3TSHRHDAC1HDAC2HDAC3
Propane SCHEMBL28426806 0.80 FFAR3 (0.47) FFAR3TSHRHDAC1HDAC2HDAC3
Ethyl Chloride SCHEMBL15011473 0.80
Propane SCHEMBL28370757 0.80 FFAR3 (0.47) FFAR3TSHRHDAC1HDAC2HDAC3
Oxalic Acid SCHEMBL5040673 0.80
Butane SCHEMBL16535758 0.80
Acetic Acid SCHEMBL9332694 0.80
Fluoroacetate SCHEMBL1483186 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013026777-A1 FLUOROALKYL S-(FLUORO)ALKYL THIOCARBONATES, A METHOD FOR THE PREPARATION OF FLUOROALKYL S-(FLUORO)ALKYL THIOCARBONATES, AND THEIR USE SOLVAY SA (BE) 2013-02-28 WO claimed
EP-2454226-A1 PROCESS FOR THE PREPARATION OF FLUOROALKYL (FLUORO)ALKYL CARBONATES AND CARBAMATES Solvay Fluor GmbH (DE) 2012-05-23 EP claimed
US-20120116111-A1 Process for the preparation of fluoroalkyl (fluoro)alkyl carbonates and carbamates SOLVAY FLUOR GMBH (DE) 2012-05-10 US claimed
WO-2011006822-A1 PROCESS FOR THE PREPARATION OF FLUOROALKYL (FLUORO)ALKYL CARBONATES AND CARBAMATES SOLVAY FLUOR GMBH (DE) 2011-01-20 WO claimed
EP-3214066-A2 PROCESS FOR THE PREPARATION OF FLUOROALKYL FLUOROFORMATES Solvay Fluor GmbH (DE) 2017-09-06 EP disclosed