SCHEMBL29137817

SCHEMBL29137817

CCCCCCCCCCCCOC1(C#N)C=CC(c2ccc(-c3ccccc3)cc2)=CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 2/20 0.35
NR5A2 O00482 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PTPN11 Q06124 4/20 0.32
SOAT1 P35610 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
RARB P10826 3/20 0.32
PTPN1 P18031 1/20 0.31
PTPN6 P29350 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 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
SCHEMBL29236110 1.00 NR5A1 (0.35) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL29137823 1.00 NR5A1 (0.35) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL29236228 1.00 NR5A1 (0.35) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL29137839 1.00 NR5A1 (0.35) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL29236280 1.00 NR5A1 (0.35) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL25187775 1.00 NR5A1 (0.35) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL29236175 0.98 NR5A1 (0.33) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL8451920 0.98 NR5A1 (0.36) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL9300431 0.98 NR5A1 (0.36) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19
SCHEMBL8450878 0.98 NR5A1 (0.36) NR5A1NR5A2L3MBTL1CYP2C9CYP2C19

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-118235072-A Optical film and polarizing plate 东曹株式会社 2024-06-21 CN disclosed
CN-117157337-A Fumaric acid diester resin, film and polarizing plate 东曹株式会社 2023-12-01 CN disclosed