SCHEMBL30008694

SCHEMBL30008694

CCN(CC)c1ccc2c(c1)Oc1ccc(Nc3cccc(C(F)(F)F)c3)cc1C21OC(=O)c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.45
FTO Q9C0B1 4/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
HTT P42858 2/20 0.42
KMT2A Q03164 2/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
SMAD3 P84022 1/20 0.42
PRMT1 Q99873 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CA12 O43570 4/20 0.40
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40

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
SCHEMBL6407625 1.00 CYP3A4 (0.45) CYP3A4FTOMEN1MAPTHTT
SCHEMBL6000823 0.92 KIF11 (0.38) CYP3A4FTOMEN1MAPTHTT
SCHEMBL21917238 0.91 CYP3A4 (0.42) CYP3A4FTOMEN1MAPTHTT
SCHEMBL6406462 0.90 CYP3A4 (0.50) CYP3A4FTOMEN1MAPTHTT
SCHEMBL12311116 0.87 CYP3A4 (0.48) CYP3A4FTOMEN1MAPTHTT
SCHEMBL15304788 0.86 MEN1 (0.37) CYP3A4FTOMEN1MAPTHTT
SCHEMBL13993800 0.86 CYP3A4 (0.45) CYP3A4FTOMEN1MAPTHTT
SCHEMBL11504597 0.86 CYP3A4 (0.48) CYP3A4FTOMEN1MAPTHTT
SCHEMBL11682974 0.84 CYP3A4 (0.52) CYP3A4FTOMEN1MAPTHTT
SCHEMBL15308177 0.84 CYP3A4 (0.34) CYP3A4FTOMEN1MAPTHTT

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-115352177-B Ultraviolet light sensitive lithographic printing plate precursor with color development function and plate making method thereof 浙江康尔达新材料股份有限公司 2023-12-08 CN disclosed
CN-117042977-A Thermosensitive recording layer forming liquid, thermosensitive recording medium, production method thereof, and image recording method 株式会社理光 2023-11-10 CN disclosed
CN-115352177-A Ultraviolet light-sensitive lithographic printing plate precursor with color development function and plate making method thereof 浙江康尔达新材料股份有限公司 2022-11-18 CN disclosed