Phenyl Vinyl Sulfide

Phenyl Vinyl Sulfide

SCHEMBL30733441

C=CC(=O)OC12CC3CC(CC(C3)C1)C2.C=CSc1ccccc1

nearest known ligand 0.36

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.36
EPHX1 P07099 1/20 0.36
CYP17A1 P05093 3/20 0.36
FAAH O00519 2/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 1/20 0.34
P2RX7 Q99572 3/20 0.33
EPHX2 P34913 1/20 0.33
NAAA Q02083 1/20 0.33
HPGD P15428 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 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
SCHEMBL43550 0.80 NAAA (0.41) CYP19A1EPHX1CYP17A1ALDH1A1EPHX2
Water SCHEMBL27689962 0.78 NAAA (0.40) CYP19A1EPHX1CYP17A1ALDH1A1EPHX2
Hydrogen Sulfide SCHEMBL27689942 0.78 NAAA (0.40) CYP19A1EPHX1CYP17A1ALDH1A1EPHX2
Methyl Alcohol SCHEMBL17107776 0.76 NAAA (0.42) CYP19A1CYP17A1ALDH1A1EPHX2NAAA
SCHEMBL4866033 0.76 DPP8 (0.35)
SCHEMBL5435451 0.75 AKR1B10 (0.38) CYP19A1KDM4EALDH1A1
SCHEMBL4860324 0.75 DPP8 (0.34) EPHX1P2RX7
Methacrylic Acid SCHEMBL1454403 0.73 NAAA (0.38) CYP19A1CYP17A1ALDH1A1EPHX2NAAA
SCHEMBL1592333 0.73 NAAA (0.33) CYP19A1ALDH1A1NAAA
Alcohol SCHEMBL17107774 0.72 NAAA (0.39) CYP19A1CYP17A1ALDH1A1EPHX2NAAA

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-115821412-B Cut-resistant ultra-high molecular weight polyethylene fiber and preparation method thereof 盐城优和博新材料有限公司 2024-01-30 CN claimed
CN-115821412-B Cut-resistant ultra-high molecular weight polyethylene fiber and preparation method thereof 盐城优和博新材料有限公司 2024-01-30 CN disclosed
CN-115821412-B Cut-resistant ultra-high molecular weight polyethylene fiber and preparation method thereof 盐城优和博新材料有限公司 2024-01-30 CN disclosed