SCHEMBL22907643

SCHEMBL22907643

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)cc2)c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.35
SERPINE1 P05121 2/20 0.33
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
KIF11 P52732 1/20 0.32
PPARG P37231 5/20 0.32
CYP19A1 P11511 1/20 0.31
TSPO P30536 1/20 0.31
PPARA Q07869 2/20 0.31
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
PGR P06401 1/20 0.30
RORA P35398 1/20 0.30
RORC P51449 1/20 0.30
RORB Q92753 1/20 0.30
PTAFR P25105 1/20 0.30

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
SCHEMBL22907641 0.94 PPARG (0.34) PTGESKIF11PPARGPPARAPGR
SCHEMBL22907671 0.92 TSPO (0.33) TSPO
SCHEMBL22907646 0.91 PPARG (0.37) KIF11PPARGPPARAALDH1A1MAPT
SCHEMBL25892340 0.89 RXRA (0.37) PTGESSERPINE1RXRARXRBKIF11
SCHEMBL22907642 0.89 APP (0.33) PPARGPPARAMAPTPGRRORA
SCHEMBL22907669 0.88 TSPO (0.38) TSPO
SCHEMBL13803516 0.88 RXRA (0.36) PTGESSERPINE1RXRARXRBKIF11
SCHEMBL13803825 0.88 RXRA (0.36) PTGESSERPINE1RXRARXRBKIF11
SCHEMBL16230905 0.88 RXRA (0.36) PTGESSERPINE1RXRARXRBKIF11
SCHEMBL22907469 0.88 APP (0.33) PTGESPPARGTSPOALDH1A1MAPT

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
US-20210020854-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-01-21 US disclosed