SCHEMBL801248

SCHEMBL801248

CCC(C)COc1ccc(/C=C/c2c(C)c3cc(C)ccc3c3ccc(C)cc23)cc1OCC(C)CC

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 1/20 0.33
AKR1C3 P42330 2/20 0.32
PRKCE Q02156 1/20 0.32
PRKCQ Q04759 1/20 0.32
PRKCD Q05655 1/20 0.32
GAA P10253 1/20 0.32
IGF1R P08069 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
HPGD P15428 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TOP2A P11388 1/20 0.32
THRB P10828 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
TUBB1 Q9H4B7 1/20 0.32
TLR8 Q9NR97 1/20 0.32
KDM4E B2RXH2 2/20 0.32

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
SCHEMBL801374 0.77 TLR8 (0.36) PDE4BALDH1A1MAPTGAATDP1
SCHEMBL801378 0.76 TLR8 (0.34) PDE4BALDH1A1MAPTGAATDP1
SCHEMBL13607200 0.75 KDM4E (0.47) PDE4BALDH1A1MAPTGAATDP1
SCHEMBL13044262 0.74 TLR8 (0.36) PDE4BALDH1A1MAPTGAATDP1
SCHEMBL14610194 0.73 TLR8 (0.38) PDE4BALDH1A1MAPTGAAIGF1R
SCHEMBL13044275 0.71 TLR8 (0.34) PDE4BALDH1A1MAPTGAATDP1
SCHEMBL12664828 0.70 TLR8 (0.35) PDE4BALDH1A1MAPTGAATDP1
SCHEMBL3505573 0.69 POLB (0.57) ALDH1A1MAPTLMNATDP1HPGD
SCHEMBL801119 0.67 KDM4E (0.33) PDE4BMAPTTDP1TLR8KDM4E
SCHEMBL14306944 0.67 NFE2L2 (0.34) PDE4BIGF1RTUBB1TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8398895-B2 Conjugated polymers and their use as organic semiconductors MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-03-19 US disclosed
US-8398895-B2 Conjugated polymers and their use as organic semiconductors MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-03-19 US disclosed
US-20120068121-A1 CONJUGATED POLYMERS AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-03-22 US disclosed
US-20120068121-A1 CONJUGATED POLYMERS AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2012-03-22 US disclosed
US-7947382-B2 Electroluminescent polymers and the use thereof MERCK PATENT GMBH (DE) 2011-05-24 US disclosed
US-7947382-B2 Electroluminescent polymers and the use thereof MERCK PATENT GMBH (DE) 2011-05-24 US disclosed
WO-2010136112-A1 CONJUGATED POLYMERS AND THEIR USE AS ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2010-12-02 WO disclosed
EP-1741149-B1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GMBH (DE) 2008-12-24 EP disclosed
US-20070205714-A1 Electroluminescent Polymers and the Use Thereof MERCK PATENT GMBH (DE) 2007-09-06 US disclosed
US-20070205714-A1 Electroluminescent Polymers and the Use Thereof MERCK PATENT GMBH (DE) 2007-09-06 US disclosed