SCHEMBL28070604

SCHEMBL28070604

CCOCc1ccccc1S

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 5/20 0.33
L3MBTL1 Q9Y468 3/20 0.33
MAPT P10636 2/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ADRA1A P35348 1/20 0.32
DPP4 P27487 1/20 0.32
CACNA1G O43497 1/20 0.32
CACNA1H O95180 1/20 0.32
CACNA1I Q9P0X4 1/20 0.32
POLB P06746 2/20 0.31
ATM Q13315 2/20 0.31
TSHR P16473 2/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
THRB P10828 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
SCHEMBL648250 0.84 IDO1 (0.39) IDO1L3MBTL1MAPTNPSR1ADRA1A
SCHEMBL20380886 0.79 IDO1 (0.33) IDO1KDM4EALDH1A1TDP1
SCHEMBL8750546 0.77 L3MBTL1 (0.44) IDO1L3MBTL1MAPTNPSR1CACNA1G
SCHEMBL8216348 0.77 IDO1 (0.38) IDO1MAPTNPSR1ADRA1ATSHR
SCHEMBL21796063 0.77 TACR1 (0.38) IDO1L3MBTL1MAPTNPSR1ADRA1A
SCHEMBL728599 0.76 SLC6A2 (0.30) L3MBTL1MAPTSLC6A2SLC6A4SLC6A3
SCHEMBL18892799 0.76 NPSR1 (0.37) IDO1L3MBTL1MAPTNPSR1ADRA1A
SCHEMBL9419149 0.76 IDO1 (0.59) IDO1MAPTPOLBTSHRALDH1A1
SCHEMBL8750455 0.76 TAAR1 (0.45) MAPTTSHRALDH1A1KMT2ATDP1
SCHEMBL327701 0.75 CYP1A2 (0.50) ATMMEN1KMT2ATDP1HPGD

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-104335083-B Polymerizable composition for optical material, the optical material and plastic lens obtained by said composition 三井化学株式会社 2017-11-24 CN disclosed
CN-107075312-A Improved solidification shaded areas for UV curing adhesives in display application 3M创新有限公司 2017-08-18 CN disclosed
CN-104160324-B Plastic polarized lens and preparation method thereof MITSUI CHEMICALS, INC. (JP) 2016-05-11 CN disclosed