SCHEMBL6583480

SCHEMBL6583480

OC(O)c1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
HPGD P15428 5/20 0.48
HSD17B10 Q99714 4/20 0.48
CYP3A4 P08684 3/20 0.48
TSHR P16473 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CYP1A2 P05177 4/20 0.48
CYP1A1 P04798 2/20 0.48
CYP1B1 Q16678 2/20 0.48
ERBB2 P04626 1/20 0.45
FYN P06241 1/20 0.45
MAOA P21397 1/20 0.45
ACHE P22303 1/20 0.45
AHR P35869 1/20 0.45
THRB P10828 1/20 0.44
KDM4E B2RXH2 5/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 4/20 0.40
MEN1 O00255 2/20 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
SCHEMBL28304704 0.87 ALDH1A1 (0.48) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL29980211 0.83 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL2400092 0.83 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL27994818 0.83 ALDH1A1 (0.45) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL17636724 0.82 ALDH1A1 (0.44) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL22127001 0.79 CYP1A2 (0.43) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL28568260 0.79 ALDH1A1 (0.41) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL16246604 0.79 ALDH1A1 (0.41) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL1782942 0.79 ALDH1A1 (0.46) ALDH1A1HPGDHSD17B10CYP3A4TSHR
SCHEMBL15917046 0.79 ALDH1A1 (0.41) ALDH1A1HPGDHSD17B10CYP3A4TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0964045-B1 Polymeric fluorescent substance and organic electroluminescence device SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
US-6403237-B1 POLYMER CONTAINING UNSATURATED AROMATIC MONOMER HEAT RESISTANCE; ORANGE TO RED; TRANSPARENT ANODE OR CATHODE SUMITOMO CHEMICAL CO., LTD. (JP) 2002-06-11 US disclosed
EP-0964045-A1 Polymeric fluorescent substance and organic electroluminescence device SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 EP disclosed