SCHEMBL728300

SCHEMBL728300

Brc1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccc(Br)cc3)c3c2-c2cccc4cccc-3c24)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.50
MAPK1 P28482 4/20 0.50
TSHR P16473 2/20 0.45
HSD17B10 Q99714 2/20 0.45
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 2/20 0.41
CASP1 P29466 2/20 0.41
CASP7 P55210 2/20 0.41
TP53 P04637 1/20 0.41
HIF1A Q16665 1/20 0.41
MAPK13 O15264 1/20 0.40
GCGR P47871 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
PLK4 O00444 1/20 0.38
AURKA O14965 1/20 0.38
JAK2 O60674 1/20 0.38

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
SCHEMBL30041529 0.92 ALDH1A1 (0.42) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL24067757 0.92 ALDH1A1 (0.42) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL13085133 0.91 ALDH1A1 (0.45) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL30040588 0.89 ALDH1A1 (0.42) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL13002341 0.89 ALDH1A1 (0.42) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL17014606 0.89 ALDH1A1 (0.42) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL728324 0.88 ALDH1A1 (0.56) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL30040778 0.88 ADORA2A (0.47) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL24067911 0.88 ADORA2A (0.47) ALDH1A1MAPK1TSHRHSD17B10ATM
SCHEMBL20561190 0.87 ALDH1A1 (0.48) ALDH1A1MAPK1TSHRHSD17B10ATM

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-8137822-B2 Synthesis of phenyl-substituted polyfluoroanthenes and the use thereof BASF AKTIENGESELLSCHAFT (DE) 2012-03-20 US disclosed
US-8137822-B2 Synthesis of phenyl-substituted polyfluoroanthenes and the use thereof BASF AKTIENGESELLSCHAFT (DE) 2012-03-20 US disclosed
US-8137822-B2 Synthesis of phenyl-substituted polyfluoroanthenes and the use thereof BASF AKTIENGESELLSCHAFT (DE) 2012-03-20 US disclosed
EP-1877518-B1 SYNTHESIS OF PHENYL-SUBSTITUTED POLYFLUOROANTHENES AND THE USE THEREOF BASF SE (DE) 2010-02-24 EP disclosed
EP-1877518-B1 SYNTHESIS OF PHENYL-SUBSTITUTED POLYFLUOROANTHENES AND THE USE THEREOF BASF SE (DE) 2010-02-24 EP disclosed
US-20080213623-A1 7,10-bis(acryloyl, styryl, or glycidyl-substituted phenyl)fluoranthene polymerized in the presence of a nickel or palladium catalyst; photopolymerized after applied to film substrate for organic light-emitting diodes; improved stability, high efficiency and quantum yield, emission maximum in blue region BASF AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
US-20080213623-A1 7,10-bis(acryloyl, styryl, or glycidyl-substituted phenyl)fluoranthene polymerized in the presence of a nickel or palladium catalyst; photopolymerized after applied to film substrate for organic light-emitting diodes; improved stability, high efficiency and quantum yield, emission maximum in blue region BASF AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
US-20080213623-A1 7,10-bis(acryloyl, styryl, or glycidyl-substituted phenyl)fluoranthene polymerized in the presence of a nickel or palladium catalyst; photopolymerized after applied to film substrate for organic light-emitting diodes; improved stability, high efficiency and quantum yield, emission maximum in blue region BASF AKTIENGESELLSCHAFT (DE) 2008-09-04 US disclosed
EP-1877518-A1 SYNTHESIS OF PHENYL-SUBSTITUTED POLYFLUOROANTHENES AND THE USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2008-01-16 EP disclosed
WO-2006114364-A1 SYNTHESIS OF PHENYL-SUBSTITUTED POLYFLUOROANTHENES AND THE USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2006-11-02 WO disclosed