SCHEMBL28429464

SCHEMBL28429464

CCc1nccn1CC(O)COc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
AGER Q15109 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.50
HPGD P15428 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 3/20 0.48
LMNA P02545 3/20 0.48
TSHR P16473 2/20 0.48
CYP2D6 P10635 1/20 0.48
HIF1A Q16665 1/20 0.48
RECQL P46063 1/20 0.48
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 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
SCHEMBL258791 0.83 MEN1 (0.76) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL18821437 0.81 AGER (0.59) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL258463 0.80 CYP1A2 (0.54) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL28619302 0.80 MEN1 (0.56) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL24982068 0.76 MEN1 (0.66) MEN1KMT2AAGERHPGDCYP1A2
SCHEMBL28346941 0.76 KDM4E (0.41) MEN1KMT2AL3MBTL1HPGDKDM4E
SCHEMBL16695024 0.76 TBXAS1 (0.49) MEN1KMT2AL3MBTL1HPGDMAPT
SCHEMBL30002229 0.75 KMT2A (0.57) MEN1KMT2AAGERL3MBTL1HPGD
SCHEMBL16808044 0.74 L3MBTL1 (0.62) MEN1KMT2AL3MBTL1CYP2C9CYP2C19
Quinoline SCHEMBL28779802 0.74 AGER (0.49) MEN1KMT2AAGERL3MBTL1HPGD

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-112745793-B Curable composition 味之素株式会社 2025-03-14 CN disclosed
CN-111315719-A Thiol compound, method for synthesizing same, and use of thiol compound 四国化成工业株式会社 2020-06-19 CN disclosed