SCHEMBL728651

SCHEMBL728651

CCCCCCCCc1ccc(-c2c(-c3ccc(CCCCCCCC)cc3)c(-c3ccc(Br)cc3)c3c(c2-c2ccc(Br)cc2)-c2cccc4cccc-3c24)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
NFKB1 P19838 1/20 0.41
MAPK1 P28482 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSD17B10 Q99714 3/20 0.40
TSHR P16473 1/20 0.40
RARB P10826 7/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
RARA P10276 2/20 0.40
MTOR P42345 1/20 0.40
ESR1 P03372 2/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 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
SCHEMBL728847 0.88 KCNH2 (0.37) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL13930580 0.79 RARB (0.48) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL4908685 0.78 HSD17B10 (0.61) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL31270913 0.78 HSD17B10 (0.61) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL26226733 0.78 HSD17B10 (0.61) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL22989786 0.78 HSD17B10 (0.61) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL10528231 0.78 HSD17B10 (0.61) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL8607022 0.78 HSD17B10 (0.61) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL10455067 0.78 HSD17B10 (0.61) RAB9ASMN1; SMN2NPC1NFKB1MAPK1
SCHEMBL16146255 0.77 RARB (0.50) RAB9ASMN1; SMN2NPC1NFKB1MAPK1

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 7 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
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
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