SCHEMBL29270262

SCHEMBL29270262

CCSC1=CCc2cccc3cccc1c23

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
KDM4E B2RXH2 3/20 0.39
HSD17B10 Q99714 3/20 0.37
TYMS P04818 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
LMNA P02545 1/20 0.36
PARP1 P09874 1/20 0.36
S100A4 P26447 2/20 0.35
SOAT1 P35610 1/20 0.35
TSHR P16473 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP1B1 Q16678 1/20 0.33
MAPK1 P28482 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CASP1 P29466 1/20 0.31
MPI P34949 1/20 0.31
CACNA1B Q00975 1/20 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
SCHEMBL29270263 0.88 SOAT1 (0.38) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL29270252 0.85 SOAT1 (0.40) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL29270246 0.83 SOAT1 (0.43) ALDH1A1HPGDKDM4ES100A4SOAT1
SCHEMBL29270291 0.83 SOAT1 (0.43) ALDH1A1HPGDKDM4ES100A4SOAT1
SCHEMBL29270265 0.83 SOAT1 (0.43) ALDH1A1HPGDKDM4ES100A4SOAT1
SCHEMBL29270293 0.83 SOAT1 (0.43) ALDH1A1HPGDKDM4ES100A4SOAT1
SCHEMBL29270238 0.79 ALDH1A1 (0.40) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL29270254 0.74 ALDH1A1 (0.39) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL29270258 0.73 ALDH1A1 (0.41) ALDH1A1HPGDKDM4EHSD17B10TYMS
SCHEMBL15967962 0.72 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EHSD17B10TYMS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115073949-B Aqueous composition, cured product, and laminate 荒川化学工业株式会社 2024-07-12 CN disclosed