SCHEMBL3711865

SCHEMBL3711865

c1ccc(-c2ccc(-c3ccc4cccc5c4c3-c3c(-c4ccccc4)ccc(-c4ccccc4)c3-5)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.41
ALDH1A1 P00352 7/20 0.40
HSD17B10 Q99714 6/20 0.40
TSHR P16473 3/20 0.40
MAPK1 P28482 2/20 0.40
ATM Q13315 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CDK4 P11802 1/20 0.37
CCND1 P24385 1/20 0.37
HPGD P15428 4/20 0.36
CASP1 P29466 2/20 0.36
CASP7 P55210 2/20 0.36
TP53 P04637 1/20 0.36
HIF1A Q16665 1/20 0.36
TNF P01375 1/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
THRB P10828 2/20 0.35

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
SCHEMBL20653095 0.86 ALDH1A1 (0.54) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL27659715 0.85 HSD17B10 (0.50) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL28151586 0.84 ALDH1A1 (0.42) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL30019679 0.81 ALDH1A1 (0.54) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL10845732 0.81 HSD17B10 (0.54) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL31107075 0.81 HSD17B10 (0.54) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL24839916 0.81 CYP2A6 (0.42) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL20561190 0.80 ALDH1A1 (0.48) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL24840291 0.80 TSHR (0.44) PDE6DALDH1A1HSD17B10TSHRMAPK1
SCHEMBL29177896 0.79 DNMT1 (0.47) ALDH1A1HSD17B10TSHRMAPK1ATM

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
EP-2218123-A1 PHOSPHORESCENT OLED DEVICE WITH CERTAIN FLUORANTHENE HOST Global OLED Technology LLC (US) 2010-08-18 EP disclosed
WO-2009054899-A1 PHOSPHORESCENT OLED DEVICE WITH CERTAIN FLUORANTHENE HOST EASTMAN KODAK COMPANY (US) 2009-04-30 WO disclosed