Vinyl Chloride

Vinyl Chloride

SCHEMBL8967461

C=CCl.C=CO.C=COC(=O)C=CC(=O)O.C=COC(C)=O

nearest known ligand 0.39

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 7/20 0.39
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TSHR P16473 2/20 0.31
TP53 P04637 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
EGLN3 Q9H6Z9 1/20 0.31
ALOX15 P16050 1/20 0.31
RECQL P46063 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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 SCHEMBL7527788 0.96 HCAR2 (0.42) HCAR2ALDH1A1KDM4EMAPTTDP1
Fumaric Acid SCHEMBL7801203 0.93 TSHR (0.36) HCAR2ALDH1A1KDM4EMAPTTDP1
SCHEMBL1598603 0.91 HCAR2 (0.46) HCAR2ALDH1A1KDM4EMAPTTDP1
SCHEMBL1598608 0.91 HCAR2 (0.46) HCAR2ALDH1A1KDM4EMAPTTDP1
Fumaric Acid SCHEMBL10836232 0.89 TSHR (0.39) HCAR2ALDH1A1KDM4EMAPTTDP1
Fumaric Acid SCHEMBL229544 0.89 TSHR (0.39) HCAR2ALDH1A1KDM4EMAPTTDP1
Maleic Acid SCHEMBL107290 0.89 TSHR (0.39) HCAR2ALDH1A1KDM4EMAPTTDP1
Maleic Acid SCHEMBL28324410 0.87 TSHR (0.38) HCAR2ALDH1A1KDM4EMAPTTDP1
Maleic Acid SCHEMBL9306995 0.87 TSHR (0.41) HCAR2ALDH1A1KDM4EMAPTTDP1
Vinyl Chloride SCHEMBL9615456 0.87 HCAR2 (0.44) HCAR2ALDH1A1KDM4EMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0312977-B1 Magnetic recording medium KONISHIROKU PHOTO IND (JP) 1996-03-06 EP disclosed
EP-0392810-B1 Magnetic recording medium KONISHIROKU PHOTO IND (JP) 1995-06-21 EP disclosed
US-5354610-A Floppy discs KONICA CORPORATION (JP) 1994-10-11 US disclosed
US-5110658-A Iron oxide powder containing silicon, vinyl chloride resin binder KONICA CORPORATION (JP) 1992-05-05 US disclosed
EP-0392810-A2 Magnetic recording medium KONICA CORPORATION (JP) 1990-10-17 EP disclosed
EP-0312977-A2 Magnetic recording medium KONICA CORPORATION (JP) 1989-04-26 EP disclosed