SCHEMBL28619302

SCHEMBL28619302

OC(COc1ccccc1)Cn1ccnc1-c1ccccc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
AGER Q15109 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.51
HPGD P15428 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
CYP2D6 P10635 1/20 0.49
TSHR P16473 1/20 0.49
HIF1A Q16665 1/20 0.49
ESR1 P03372 1/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
RECQL P46063 1/20 0.49
PKM P14618 1/20 0.46
CHRNA7 P36544 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
Quinoline SCHEMBL28189854 0.89 AGER (0.51) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL28491040 0.88 KMT2A (0.46) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL12446425 0.85 KMT2A (0.56) MEN1KMT2AAGERHPGDKDM4E
SCHEMBL258791 0.84 MEN1 (0.76) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL14389019 0.84 KMT2A (0.52) MEN1KMT2AAGERHPGDKDM4E
SCHEMBL24982068 0.83 MEN1 (0.66) MEN1KMT2AAGERHPGDKDM4E
SCHEMBL5858402 0.82 ESR1 (0.54) MEN1KMT2AAGERKDM4EESR1
SCHEMBL18821437 0.82 AGER (0.59) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL13896554 0.80 KMT2A (0.48) MEN1KMT2AAGERHPGDKDM4E
SCHEMBL29886581 0.80 MEN1 (0.76) MEN1KMT2AAGERHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115124813-A Resin composition 味之素株式会社 2022-09-30 CN disclosed
CN-110431168-B Curable composition and structure 味之素株式会社 2022-04-29 CN disclosed
CN-114276298-A Thiol compound, method for synthesizing same, and use of thiol compound 四国化成工业株式会社 2022-04-05 CN disclosed
CN-114213333-A Thiol compound, method for synthesizing same, and use of thiol compound 四国化成工业株式会社 2022-03-22 CN disclosed
CN-113444340-A Resin composition 味之素株式会社 2021-09-28 CN disclosed
CN-113272274-A Thiol compound, synthesis method thereof and application of thiol compound 四国化成工业株式会社 2021-08-17 CN disclosed