SCHEMBL14280384

SCHEMBL14280384

CCCCn1c2ccccc2c(=O)c2cc(C(C)(C)C)ccc21

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PGR P06401 8/20 0.74
RORA P35398 8/20 0.74
RORC P51449 8/20 0.74
RORB Q92753 8/20 0.74
ALDH1A1 P00352 4/20 0.51
NPC1 O15118 3/20 0.50
SLC6A4 P31645 2/20 0.50
SLC6A2 P23975 1/20 0.50
HRH1 P35367 1/20 0.50
CNR2 P34972 1/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48

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
SCHEMBL14280407 0.93 RORA (0.71) PGRRORARORCRORBALDH1A1
SCHEMBL14280387 0.92 PGR (0.67) PGRRORARORCRORBALDH1A1
SCHEMBL14141741 0.85 RORA (1.00) PGRRORARORCRORBNPC1
SCHEMBL14493936 0.84 RORA (0.62) PGRRORARORCRORBALDH1A1
SCHEMBL29654225 0.84 RORA (0.62) PGRRORARORCRORBALDH1A1
SCHEMBL10730998 0.84 PGR (0.70) PGRRORARORCRORBALDH1A1
SCHEMBL8085590 0.82 PGR (0.71) PGRRORARORCRORBALDH1A1
SCHEMBL8086740 0.81 RORA (0.55) PGRRORARORCRORBALDH1A1
SCHEMBL29543602 0.81 RORA (0.55) PGRRORARORCRORBALDH1A1
SCHEMBL22042197 0.80 RORA (0.63) PGRRORARORCRORBCNR2

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
US-20080020323-A1 Light sensitive planographic printing plate material KONICA MINOLTA MEDICAL & GRAPHIC, INC. 2008-01-24 US disclosed
US-20080020323-A1 Light sensitive planographic printing plate material KONICA MINOLTA MEDICAL & GRAPHIC, INC. 2008-01-24 US disclosed