SCHEMBL680571

SCHEMBL680571

CCCCC(CC)COc1cc(/C=C/c2cc(OC)c(Br)cc2OC)c(OC)cc1/C=C/c1cc(OC)c(Br)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.37
HTR2A P28223 5/20 0.37
PTPN1 P18031 4/20 0.36
TAAR1 Q96RJ0 2/20 0.36
PRKDC P78527 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
CA2 P00918 1/20 0.33
TNFRSF1A P19438 1/20 0.33

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
SCHEMBL2764142 1.00 TDP1 (0.37) TDP1HTR2APTPN1TAAR1PRKDC
SCHEMBL7645902 0.88 HTR2A (0.43) TDP1HTR2ATAAR1ALDH1A1MAPK1
SCHEMBL4582176 0.87 TNFRSF1A (0.32) TDP1HTR2APTPN1TAAR1PRKDC
SCHEMBL2804053 0.83 TDP1 (0.46) TDP1ALDH1A1MAPK1CA2
SCHEMBL2053675 0.82 CYP3A4 (0.43) TDP1ALDH1A1MAPK1CA2
SCHEMBL2037739 0.82 LMNA (0.46) TDP1PRKDCALDH1A1MAPK1CA2
SCHEMBL7475244 0.82 ALDH1A1 (0.47) TDP1PRKDCALDH1A1MAPK1CA2
SCHEMBL6846661 0.81 APP (0.50) TDP1MAPK1
SCHEMBL17776459 0.81 TDP1 (0.37) TDP1PTPN1ALDH1A1MAPK1CA2
SCHEMBL28083440 0.79 CYP3A4 (0.43) TDP1ALDH1A1MAPK1CA2

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8053547-B2 Conjugated polymers and blends containing carbazole, representation and use thereof MERCK PATENT GMBH (DE) 2011-11-08 US disclosed
US-8044217-B2 White-emitting copolymers, representation, and use thereof MERCK PATENT GMBH (DE) 2011-10-25 US disclosed
US-8044217-B2 White-emitting copolymers, representation, and use thereof MERCK PATENT GMBH (DE) 2011-10-25 US disclosed
US-20110068304-A1 Conjugated Polymers and Blends Containing Carbazole, Representation and Use Thereof MERCK PATENT GMBH (DE) 2011-03-24 US disclosed
US-20110068304-A1 Conjugated Polymers and Blends Containing Carbazole, Representation and Use Thereof MERCK PATENT GMBH (DE) 2011-03-24 US disclosed
US-7910687-B2 Conjugated polymers containing arylamine units, the representation thereof and the use of the same MERCK PATENT GMBH (DE) 2011-03-22 US disclosed
US-7910687-B2 Conjugated polymers containing arylamine units, the representation thereof and the use of the same MERCK PATENT GMBH (DE) 2011-03-22 US disclosed
EP-1915788-B1 SOLVENT MIXTURES FOR ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2010-12-15 EP disclosed
US-7834136-B2 Conjugated polymers and blends containing carbazole, representation and use thereof COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2010-11-16 US disclosed
US-7834136-B2 Conjugated polymers and blends containing carbazole, representation and use thereof COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2010-11-16 US disclosed
US-20070060736-A1 Conjugated polymers containing dihydrophenanthrene units and use thereof MERCK PATENT GMBH (DE) 2007-03-15 US disclosed
US-20070060736-A1 Conjugated polymers containing dihydrophenanthrene units and use thereof MERCK PATENT GMBH (DE) 2007-03-15 US disclosed
US-20070060736-A1 Conjugated polymers containing dihydrophenanthrene units and use thereof MERCK PATENT GMBH (DE) 2007-03-15 US disclosed
WO-2007019944-A1 SOLVENT MIXTURE FOR ORGANIC SEMICONDUCTORS MERCK PATENT GMBH (DE) 2007-02-22 WO disclosed
EP-1427768-B1 CONJUGATED POLYMERS CONTAINING SPIROBIFLUORENE UNITS AND THE USE THEREOF MERCK PATENT GMBH (DE) 2007-01-24 EP disclosed
EP-1656408-A2 CONJUGATED POLYMERS CONTAINING DIHYDROPHENANTHRENE UNITS AND USE THEREOF Covion Organic Semiconductors GmbH (DE) 2006-05-17 EP disclosed
US-20050038223-A1 Conjugated polymers containing spirobifluorene units and the use thereof MERCK PATENT GMBH (DE) 2005-02-17 US disclosed
WO-2005014689-A2 CONJUGATED POLYMERS CONTAINING DIHYDROPHENANTHRENE UNITS AND USE THEREOF COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2005-02-17 WO disclosed
EP-1427768-A2 CONJUGATED POLYMERS CONTAINING SPIROBIFLUORENE UNITS AND THE USE THEREOF Covion Organic Semiconductors GmbH (DE) 2004-06-16 EP disclosed
WO-2003020790-A2 CONJUGATED POLYMERS CONTAINING SPIROBIFLUORENE UNITS AND THE USE THEREOF COVION ORGANIC SEMICONDUCTORS GMBH (DE) 2003-03-13 WO disclosed