SCHEMBL1304448

SCHEMBL1304448

O=C1c2ccccc2C(=O)c2cc3cc(Br)ccc3cc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 2/20 0.62
CYP2A6 P11509 1/20 0.56
BCL2 P10415 3/20 0.50
MCL1 Q07820 2/20 0.50
MAPK1 P28482 3/20 0.49
CYP1A2 P05177 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
S100A4 P26447 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CDC25B P30305 1/20 0.48
ALDH1A1 P00352 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
ELANE P08246 1/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL16407237 0.94 CYP2A6 (0.64) PTPRCCYP2A6BCL2MCL1MAPK1
SCHEMBL17859354 0.92 CYP2A6 (0.61) PTPRCCYP2A6BCL2MCL1MAPK1
SCHEMBL29649816 0.92 S100A4 (0.56) PTPRCCYP2A6BCL2MCL1MAPK1
SCHEMBL15210982 0.92 S100A4 (0.56) PTPRCCYP2A6BCL2MCL1MAPK1
SCHEMBL15210826 0.92 S100A4 (0.56) PTPRCCYP2A6BCL2MCL1MAPK1
SCHEMBL11959834 0.90 PTPRC (0.51) PTPRCCYP2A6BCL2MCL1MAPK1
SCHEMBL12877800 0.86 PTPRC (0.70) PTPRCCYP2A6BCL2MCL1MAPK1
SCHEMBL17836984 0.84 PTPRC (0.68) PTPRCCYP2A6BCL2MCL1MAPK1
SCHEMBL391353 0.83 PTPRC (0.87) PTPRCBCL2MCL1MAPK1CYP1A2
SCHEMBL824162 0.81 PTPRC (0.91) PTPRCBCL2MCL1MAPK1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016100754-A1 QUANTITATIVE INTRAMOLECULAR FISSION IN OLIGOACENES, MATERIALS, AND METHODS OF USE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2016-06-23 WO disclosed
EP-2482354-A1 Thin film transistor comprising novel conductor and dielectric compositions E. I. du Pont de Nemours and Company (US) 2012-08-01 EP disclosed
EP-2482354-A1 Thin film transistor comprising novel conductor and dielectric compositions E. I. du Pont de Nemours and Company (US) 2012-08-01 EP disclosed
EP-2482355-A1 Thin film transistor comprising novel conductor and dielectric compositions E. I. du Pont de Nemours and Company (US) 2012-08-01 EP disclosed
EP-2482355-A1 Thin film transistor comprising novel conductor and dielectric compositions E. I. du Pont de Nemours and Company (US) 2012-08-01 EP disclosed
US-8053840-B2 Thin film transistor comprising novel conductor and dielectric compositions E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-11-08 US disclosed
US-8053840-B2 Thin film transistor comprising novel conductor and dielectric compositions E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-11-08 US disclosed
US-8053840-B2 Thin film transistor comprising novel conductor and dielectric compositions E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-11-08 US disclosed
US-20090179198-A1 THIN FILM TRANSISTOR COMPRISING NOVEL CONDUCTOR AND DIELECTRIC COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-07-16 US disclosed
US-20090179198-A1 THIN FILM TRANSISTOR COMPRISING NOVEL CONDUCTOR AND DIELECTRIC COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-07-16 US disclosed
US-7528448-B2 Thin film transistor comprising novel conductor and dielectric compositions E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-05-05 US disclosed
US-7528448-B2 Thin film transistor comprising novel conductor and dielectric compositions E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-05-05 US disclosed
US-7528448-B2 Thin film transistor comprising novel conductor and dielectric compositions E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-05-05 US disclosed
EP-2041816-A2 THIN FILM TRANSISTOR COMPRISING NOVEL CONDUCTOR AND DIELECTRIC COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2009-04-01 EP disclosed
WO-2008010983-A2 THIN FILM TRANSISTOR COMPRISING NOVEL CONDUCTOR AND DIELECTRIC COMPOSITIONS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-01-24 WO disclosed
US-20080012006-A1 Thin film transistor comprising novel conductor and dielectric compositions E. I. DU PONT DE NEMOURS AND COMPANY 2008-01-17 US disclosed
US-20080012006-A1 Thin film transistor comprising novel conductor and dielectric compositions E. I. DU PONT DE NEMOURS AND COMPANY 2008-01-17 US disclosed
US-20080012006-A1 Thin film transistor comprising novel conductor and dielectric compositions E. I. DU PONT DE NEMOURS AND COMPANY 2008-01-17 US disclosed
EP-1869720-A2 ARYL-ETHYLENE SUBSTITUTED AROMATIC COMPOUNDS AND THEIR USE AS ORGANIC SEMICONDUCTORS E.I.Du pont de nemours and company (US) 2007-12-26 EP disclosed
WO-2006113205-A2 ARYL-ETHYLENE SUBSTITUTED AROMATIC COMPOUNDS AND THEIR USE AS ORGANIC SEMICONDUCTORS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-10-26 WO disclosed