Ethyl Chloride

Ethyl Chloride

SCHEMBL5032981

C=CC(=O)OC(C)C(c1ccccc1)N(C)C.CCCl

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
LMNA P02545 3/20 0.38
THRB P10828 2/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
KCNH2 Q12809 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
THRA P10827 1/20 0.33
GAA P10253 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TP53 P04637 1/20 0.33
OPRM1 P35372 1/20 0.33

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
SCHEMBL5664548 0.93 HCAR2 (0.43) HCAR2LMNATHRBCHRNB2CHRNB4
Fluoride SCHEMBL28527584 0.92 HCAR2 (0.42) HCAR2LMNATHRBCHRNB2CHRNB4
Bromide SCHEMBL28534138 0.92 HCAR2 (0.42) HCAR2LMNATHRBCHRNB2CHRNB4
Iodide SCHEMBL22042239 0.92 HCAR2 (0.42) HCAR2LMNATHRBCHRNB2CHRNB4
Hydrochloric Acid SCHEMBL5000725 0.92 HCAR2 (0.42) HCAR2LMNATHRBCHRNB2CHRNB4
Iodide SCHEMBL21693887 0.84 HCAR2 (0.41) HCAR2LMNATHRBCYP2C19ALDH1A1
Bromide SCHEMBL21693860 0.84 HCAR2 (0.41) HCAR2LMNATHRBCYP2C19ALDH1A1
Fluoride SCHEMBL28507999 0.84 HCAR2 (0.41) HCAR2LMNATHRBCYP2C19ALDH1A1
Hydrochloric Acid SCHEMBL21693858 0.84 HCAR2 (0.41) HCAR2LMNATHRBCYP2C19ALDH1A1
Iodide SCHEMBL28537837 0.84 LMNA (0.38) HCAR2LMNATHRBCHRNB2CHRNB4

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-20080281064-A1 Novel Glycopolymers, Uses Thereof, and Monomers Useful for Preparation Thereof RHODIA CHIMIE (FR) 2008-11-13 US claimed
US-20080281064-A1 Novel Glycopolymers, Uses Thereof, and Monomers Useful for Preparation Thereof RHODIA CHIMIE (FR) 2008-11-13 US disclosed