Vinyl Chloride

Vinyl Chloride

SCHEMBL8772048

C=CCl.CC(C)COCC(C)C

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.32
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 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
Vinyl Chloride SCHEMBL27412872 0.97 TSHR (0.39) TSHRALDH1A1ADH1BADH1CADH1A
Vinyl Chloride SCHEMBL28118134 0.90 TSHR (0.35) TSHR
Butadiene SCHEMBL13858139 0.85 TSHR (0.42) TSHRALDH1A1ADH1BADH1CADH1A
SCHEMBL27831780 0.83 TSHR (0.34) TSHR
Ethylene SCHEMBL27266689 0.81 ALDH1A1 (0.38) TSHRALDH1A1ADH1BADH1CADH1A
SCHEMBL24856 0.80
Vinyl Chloride SCHEMBL2557227 0.78 TSHR (0.38) TSHR
Methylene Chloride SCHEMBL27532794 0.78 ALDH1A1 (0.36) TSHRALDH1A1ADH1BADH1CADH1A
SCHEMBL15400759 0.77 ALDH1A1 (0.40) TSHRALDH1A1ADH1BADH1CADH1A
Water SCHEMBL20597605 0.77 ALDH1A1 (0.40) TSHRALDH1A1ADH1BADH1CADH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107090229-A A kind of general purpose epoxy resin priming paint with good environment adaptability and preparation method thereof 上海古象化工科技发展有限公司 2017-08-25 CN disclosed
CN-107090229-A A kind of general purpose epoxy resin priming paint with good environment adaptability and preparation method thereof 上海古象化工科技发展有限公司 2017-08-25 CN disclosed
EP-0475379-B1 Use of an image receiving sheet for heat transfer recording KONISHIROKU PHOTO IND (JP) 1997-08-20 EP disclosed