1,1-Dichloroethene

1,1-Dichloroethene

SCHEMBL8510976

C=C(C=CC#N)C(=O)OCCCC.C=C(Cl)Cl

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.46
TSHR P16473 6/20 0.44
HPGD P15428 1/20 0.44
HCAR2 Q8TDS4 3/20 0.41
NPSR1 Q6W5P4 2/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
ALDH1A1 P00352 2/20 0.37
TP53 P04637 1/20 0.35
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
APP P05067 1/20 0.33
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NAAA Q02083 1/20 0.31
ESR1 P03372 1/20 0.31
RAD52 P43351 1/20 0.30

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
SCHEMBL2259513 0.95 ATM (0.50) ATMTSHRHPGDHCAR2NPSR1
Butadiene SCHEMBL9419686 0.91 TSHR (0.47) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL11682342 0.90 TSHR (0.54) ATMTSHRHPGDHCAR2NPSR1
Acrylic Acid SCHEMBL17387529 0.89 TSHR (0.49) ATMTSHRHPGDHCAR2NPSR1
Acrylic Acid Ethyl Ester SCHEMBL13685085 0.86 TSHR (0.54) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL9453892 0.86 TSHR (0.48) ATMTSHRHPGDHCAR2NPSR1
Acrylic Acid Methyl Ester SCHEMBL10836090 0.86 TSHR (0.50) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL5973081 0.86 HCAR2 (0.42) ATMTSHRHPGDHCAR2ALDH1A1
SCHEMBL13275897 0.85 TSHR (0.50) ATMTSHRHPGDHCAR2NPSR1
SCHEMBL11701988 0.84 TSHR (0.55) ATMTSHRHPGDHCAR2NPSR1

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-5954683-A POLYVINYL ALCOHOL PLAYTEX PRODUCTS, INC. (US) 1999-09-21 US claimed
US-5954683-A POLYVINYL ALCOHOL PLAYTEX PRODUCTS, INC. (US) 1999-09-21 US disclosed