SCHEMBL28068384

SCHEMBL28068384

CCOC(OCC)C(=O)c1ccccc1.O=C(c1ccccc1)C(Cl)(Cl)Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
PGR P06401 1/20 0.41
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41
KCNH2 Q12809 1/20 0.41
NPC1 O15118 2/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CES1 P23141 2/20 0.39
SRC P12931 1/20 0.39
LMNA P02545 2/20 0.39
HSD17B10 Q99714 1/20 0.39
PRSS1 P07477 2/20 0.38
CTSG P08311 2/20 0.38
CTRB1 P17538 2/20 0.38
CMA1 P23946 2/20 0.38
MDM2 Q00987 1/20 0.38
ALDH1A1 P00352 3/20 0.37

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
SCHEMBL57444 0.87 PGR (0.44) SMN1; SMN2PGRADRA2AADRA2BHTR2A
SCHEMBL5168028 0.87 PGR (0.52) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL23238 0.87 PGR (0.52) PGRADRA2AADRA2BHTR2AHRH1
Benzene SCHEMBL28162079 0.85 PGR (0.50) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL7609030 0.84 SRC (0.42) PGRADRA2AADRA2BHTR2AHRH1
Acetic Acid SCHEMBL27715708 0.83 PGR (0.49) PGRADRA2AADRA2BHTR2AHRH1
Benzil SCHEMBL10413820 0.82 CES2 (0.52) SMN1; SMN2PGRADRA2AADRA2BHTR2A
Benzophenone SCHEMBL9682804 0.82 ALDH1A1 (0.52) SMN1; SMN2PGRADRA2AADRA2BHTR2A
SCHEMBL10943759 0.80 ELANE (0.51) SMN1; SMN2PGRADRA2AADRA2BHTR2A
Acetophenone SCHEMBL27577117 0.80 PGR (0.46) SMN1; SMN2PGRADRA2AADRA2BHTR2A

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-105733459-A Adhesive sheet and optical member 日东电工株式会社 2016-07-06 CN disclosed
CN-105733460-A Adhesive sheet and optical member 日东电工株式会社 2016-07-06 CN disclosed
CN-105733461-A Adhesive sheet and optical member 日东电工株式会社 2016-07-06 CN disclosed