SCHEMBL30450064

SCHEMBL30450064

CCCCn1c(C)c(C2OC(=O)c3ccccc32)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.47
RORA P35398 2/20 0.47
RORC P51449 2/20 0.47
RORB Q92753 2/20 0.47
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 2/20 0.44
LMNA P02545 2/20 0.44
HPGD P15428 1/20 0.44
CNR2 P34972 6/20 0.43
CNR1 P21554 3/20 0.43
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SLC6A3 Q01959 1/20 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
SCHEMBL1302079 1.00 PGR (0.47) PGRRORARORCRORBALDH1A1
SCHEMBL22588941 0.97 CNR2 (0.45) PGRRORARORCRORBCNR2
SCHEMBL29429253 0.95 CNR2 (0.45) PGRRORARORCRORBALDH1A1
SCHEMBL7989453 0.95 CNR2 (0.45) PGRRORARORCRORBALDH1A1
SCHEMBL5188766 0.95 CNR2 (0.45) PGRRORARORCRORBALDH1A1
SCHEMBL1832098 0.88 ALDH1A1 (0.44) PGRALDH1A1KDM4EPOLBTDP1
SCHEMBL30158292 0.88 ALDH1A1 (0.44) PGRALDH1A1KDM4EPOLBTDP1
SCHEMBL29228946 0.85 PGR (0.40) PGRRORARORCRORBALDH1A1
SCHEMBL11103828 0.84 PGR (0.47) PGRRORARORCRORBALDH1A1
SCHEMBL8713616 0.82 CNR2 (0.44) PGRRORARORCRORBALDH1A1

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
WO-2023085225-A1 METHOD FOR MANUFACTURING RECYCLED RESIN COMPOSITION 住友化学株式会社 2023-05-19 WO disclosed