Ethyl Chloride

Ethyl Chloride

SCHEMBL28779028

C=CC(=O)OCCN(CC)CC.CCCl

nearest known ligand 0.52

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.52
HPGD P15428 2/20 0.52
ALDH1A1 P00352 5/20 0.47
TP53 P04637 2/20 0.47
HIF1A Q16665 2/20 0.47
CYP3A4 P08684 2/20 0.47
HSD17B10 Q99714 1/20 0.47
THRB P10828 1/20 0.44
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP2D6 P10635 2/20 0.41
LMNA P02545 2/20 0.41
MAOA P21397 2/20 0.41
HTR3A P46098 2/20 0.41
HRH3 Q9Y5N1 2/20 0.41
CYP1A2 P05177 1/20 0.41
BLM P54132 1/20 0.40

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
Chloromethane SCHEMBL1127607 0.95 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL14924 0.94 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11118611 0.93 TSHR (0.49) TSHRHPGDALDH1A1TP53HIF1A
Ammonia Solution, Strong SCHEMBL27767919 0.93 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL9185674 0.93 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL27554838 0.93 TSHR (0.55) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL28153939 0.91 TSHR (0.53) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL10698787 0.91 TSHR (0.57) TSHRHPGDALDH1A1TP53HIF1A
Acrylic Acid Ethyl Ester SCHEMBL10940378 0.89 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A
Acetic Acid SCHEMBL9226545 0.89 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109070025-B Method and device for preparing aqueous polymer solution 巴斯夫欧洲公司 2022-06-07 CN disclosed