SCHEMBL28596276

SCHEMBL28596276

C1=CC(c2cccc3ccccc23)SS1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.43
SLC6A4 P31645 5/20 0.40
SLC6A2 P23975 2/20 0.39
SLC6A3 Q01959 2/20 0.39
MTNR1A P48039 2/20 0.37
IDO1 P14902 1/20 0.37
ALDH1A1 P00352 4/20 0.36
CYP2A6 P11509 3/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP2 O95551 1/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP3 P42574 1/20 0.36
HTT P42858 1/20 0.36
GALK1 P51570 1/20 0.36

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
SCHEMBL29450640 0.68 HTR2C (0.44) KDM1ASLC6A4SLC6A2SLC6A3KDM4E
SCHEMBL11023640 0.67 KDM1A (0.48) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A
SCHEMBL29261821 0.65 KDM1A (0.52) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A
SCHEMBL8008207 0.65 KDM1A (0.43) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A
SCHEMBL30477104 0.64 SLC6A4 (0.59) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A
SCHEMBL248440 0.64 SLC6A4 (0.59) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A
SCHEMBL10640806 0.64 KDM1A (0.50) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A
SCHEMBL825994 0.63 KDM1A (0.41) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A
SCHEMBL5699413 0.63 SLC6A4 (0.50) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A
SCHEMBL6675754 0.63 KDM1A (0.53) KDM1ASLC6A4SLC6A2SLC6A3MTNR1A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115894882-A Thioether-containing liquid crystal polymer with excellent performance and preparation method thereof 常州瑞杰新材料科技有限公司 2023-04-04 CN claimed
CN-115894882-B Liquid crystal polymer containing sulfur ether with excellent performance and preparation method thereof 常州瑞杰新材料科技有限公司 2024-02-27 CN disclosed
CN-115894882-A Thioether-containing liquid crystal polymer with excellent performance and preparation method thereof 常州瑞杰新材料科技有限公司 2023-04-04 CN disclosed
CN-107848983-B Compound, resin, material for forming underlayer film for lithography, resist pattern, method for forming circuit pattern, and method for purifying resist pattern 三菱瓦斯化学株式会社 2021-07-09 CN disclosed