SCHEMBL28547488

SCHEMBL28547488

C=CCOc1cccc(S)c1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LIG1 P18858 1/20 0.41
ADRB2 P07550 2/20 0.40
ADRB1 P08588 2/20 0.40
SLC22A1 O15245 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
HTR1A P08908 1/20 0.40
CYP2D6 P10635 1/20 0.40
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
ADRA1A P35348 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2A6 P11509 1/20 0.39
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38

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
SCHEMBL4620025 0.81 HPGD (0.51) HPGDTSHRMAPK1HSD17B10LIG1
SCHEMBL8637602 0.81 LIG1 (0.44) HPGDTSHRMAPK1HSD17B10LIG1
SCHEMBL28538422 0.81 HPGD (0.46) HPGDTSHRMAPK1HSD17B10LIG1
SCHEMBL28547491 0.75 HPGD (0.46) HPGDTSHRMAPK1HSD17B10LIG1
1,2-Diallyloxybenzene SCHEMBL29768784 0.74 HPGD (0.60) HPGDTSHRMAPK1HSD17B10LIG1
1,2-Diallyloxybenzene SCHEMBL366516 0.74 HPGD (0.60) HPGDTSHRMAPK1HSD17B10LIG1
SCHEMBL515196 0.74 ADRB2 (0.59) HPGDTSHRMAPK1HSD17B10LIG1
SCHEMBL4957321 0.74 MAPT (0.50) HPGDTSHRMAPK1HSD17B10LIG1
SCHEMBL20454563 0.73 HPGD (0.47) HPGDTSHRMAPK1HSD17B10LIG1
SCHEMBL5611931 0.72 ADRB2 (0.47) HPGDTSHRMAPK1HSD17B10LIG1

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
CN-112500703-A Acoustic thin film and preparation method thereof 湖南七纬科技有限公司 2021-03-16 CN claimed
CN-112500703-A Acoustic thin film and preparation method thereof 湖南七纬科技有限公司 2021-03-16 CN disclosed