SCHEMBL17010941

SCHEMBL17010941

C[Si]1(C)c2ccccc2-c2cc3cc4c(cc3cc21)-c1ccccc1[Si]4(C)C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.49
RORA P35398 2/20 0.49
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RORB Q92753 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
SCHEMBL17010950 1.00 RORC (0.49) RORCRORAALDH1A1TP53HPGD
SCHEMBL13451241 0.89 RORC (0.53) RORCRORARORB
SCHEMBL10018675 0.86 RORC (0.51) RORCRORARORB
SCHEMBL17739670 0.84 ALDH1A1 (0.41) RORCRORAALDH1A1TP53HPGD
SCHEMBL29768232 0.83 RORC (0.50) RORCRORAALDH1A1TP53HPGD
SCHEMBL1107762 0.83 RORC (0.50) RORCRORAALDH1A1TP53HPGD
SCHEMBL18611020 0.80 RORA (0.41) RORCRORAMAPK1
SCHEMBL18665755 0.80 RORA (0.41) RORCRORAALDH1A1HIF1AHSD17B10
SCHEMBL13309013 0.79 ALDH1A1 (0.53) RORCRORAALDH1A1TP53HPGD
SCHEMBL18665900 0.79 RORC (0.43) RORCRORAALDH1A1HIF1AHSD17B10

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-9112157-B2 Hole transport materials including OLED applications SOLVAY USA, INC. (US) 2015-08-18 US disclosed
US-9112157-B2 Hole transport materials including OLED applications SOLVAY USA, INC. (US) 2015-08-18 US disclosed